Table 7.
HS-GC-IMS integration parameters of volatile compounds in tested honey samples.
| Count | Compound | CAS # | Formula | MW | RI | Rt (sec) | Dt (a.u.) | Comment |
|---|---|---|---|---|---|---|---|---|
| 1 | Citral | C5392405 | C10H16O | 152.2 | 1482.3 | 1033.197 | 1.19082 | |
| 2 | 2,3-diethyl-5-methylpyrazine | C18138040 | C9H14N2 | 150.2 | 1164.3 | 580.939 | 1.27668 | |
| 3 | Cis-3,7-dimethyl-octa-2,6-dien-1-ol | C624157 | C10H18O | 154.3 | 1237.4 | 684.886 | 1.21783 | |
| 4 | Citronellal-M | C106230 | C10H18O | 154.3 | 1159.6 | 574.247 | 1.34073 | Monomer |
| 5 | 2-Ethyl-3,5-dimethylpyrazine | C13925070 | C8H12N2 | 136.2 | 1111.3 | 505.545 | 1.21609 | |
| 6 | Methyl octanoate-D | C111115 | C9H18O2 | 158.2 | 1110.1 | 503.76 | 1.94657 | Dimer |
| 7 | Citronellal-D | C106230 | C10H18O | 154.3 | 1157.2 | 570.715 | 1.84501 | Dimer |
| 8 | Linalool oxide-M | C60047178 | C10H18O2 | 170.3 | 1069.3 | 445.773 | 1.25933 | Monomer |
| 9 | Linalool oxide-D | C60047178 | C10H18O2 | 170.3 | 1068.3 | 444.363 | 1.81632 | Dimer |
| 10 | Trans-linalool oxide-M | C34995772 | C10H18O2 | 170.3 | 1090.1 | 475.387 | 1.26101 | Monomer |
| 11 | Trans-linalool oxide-D | C34995772 | C10H18O2 | 170.3 | 1085.8 | 469.182 | 1.81801 | Dimer |
| 12 | 1-phenylethanol-M | C98862 | C8H8O | 120.2 | 1060.4 | 433.081 | 1.18844 | Monomer |
| 13 | 1-phenylethanol-D | C98862 | C8H8O | 120.2 | 1060.6 | 433.363 | 1.56989 | Dimer |
| 14 | (Z)-2-octenal-M | C20664464 | C8H14O | 126.2 | 1050 | 418.281 | 1.32378 | Monomer |
| 15 | (Z)-2-octenal-D | C20664464 | C8H14O | 126.2 | 1046.1 | 412.758 | 1.73993 | Dimer |
| 16 | (E)-3-Octen-2-one-M | C18402829 | C8H14O | 126.2 | 1027.8 | 386.771 | 1.32197 | Monomer |
| 17 | (E)-3-Octen-2-one-D | C18402829 | C8H14O | 126.2 | 1029 | 388.395 | 1.73811 | Dimer |
| 18 | Benzene acetaldehyde-M | C122781 | C8H8O | 120.2 | 1040.6 | 404.962 | 1.25837 | Monomer |
| 19 | Octanal-M | C124130 | C8H16O | 128.2 | 1005.5 | 354.937 | 1.41465 | Monomer |
| 20 | Benzaldehyde-M | C100527 | C7H6O | 106.1 | 958.7 | 310.758 | 1.14933 | Monomer |
| 21 | Benzaldehyde-D | C100527 | C7H6O | 106.1 | 959.5 | 311.412 | 1.47185 | Dimer |
| 22 | (E,E)-2,4-Octadienal-M | C30361285 | C8H12O | 124.2 | 1124.2 | 523.896 | 1.26822 | Monomer |
| 23 | (E,E)-2,4-Octadienal-D | C30361285 | C8H12O | 124.2 | 1123 | 522.193 | 1.77926 | Dimer |
| 24 | Benzene acetaldehyde-D | C122781 | C8H8O | 120.2 | 1040 | 404.118 | 1.54104 | Dimer |
| 25 | Heptanol | C53535334 | C7H16O | 116.2 | 976.8 | 325.815 | 1.39978 | |
| 26 | Methyl octanoate-M | C111115 | C9H18O2 | 158.2 | 1109.8 | 503.387 | 1.48176 | Monomer |
| 27 | 3-Methylpentanoic acid | C105431 | C6H12O2 | 116.2 | 958.6 | 310.64 | 1.59685 | |
| 28 | Oct-1-en-3-ol | C3391864 | C8H16O | 128.2 | 983.6 | 331.468 | 1.15686 | |
| 29 | Octanal-D | C124130 | C8H16O | 128.2 | 1005.8 | 355.465 | 1.82448 | Dimer |
| 30 | 2-Acetylfuran-M | C1192627 | C6H6O2 | 110.1 | 911.8 | 271.782 | 1.11613 | Monomer |
| 31 | Heptanal-M | C111717 | C7H14O | 114.2 | 900.1 | 262.034 | 1.33289 | Monomer |
| 32 | Heptanal-D | C111717 | C7H14O | 114.2 | 900.9 | 262.644 | 1.69957 | Dimer |
| 33 | Cyclohexanone-M | C108941 | C6H10O | 98.1 | 894.8 | 257.566 | 1.15362 | Monomer |
| 34 | Cyclohexanone-D | C108941 | C6H10O | 98.1 | 894.8 | 257.566 | 1.45511 | Dimer |
| 35 | Furfural-M | C98011 | C5H4O2 | 96.1 | 829.2 | 221.417 | 1.08191 | Monomer |
| 36 | Furfural-D | C98011 | C5H4O2 | 96.1 | 828 | 220.808 | 1.33289 | Dimer |
| 37 | Hexanal-M | C66251 | C6H12O | 100.2 | 793 | 201.921 | 1.26118 | Monomer |
| 38 | Hexanal-D | C66251 | C6H12O | 100.2 | 793 | 201.921 | 1.56105 | Dimer |
| 39 | 2,3-Butanediol | C513859 | C4H10O2 | 90.1 | 781.5 | 196.082 | 1.35718 | |
| 40 | (Z)-2-Heptenal-M | C57266861 | C7H12O | 112.2 | 945.6 | 299.871 | 1.21477 | Monomer |
| 41 | (Z)-2-Heptenal-D | C57266861 | C7H12O | 112.2 | 946.8 | 300.885 | 1.67467 | Dimer |
| 42 | 3-methylbutan-1-ol | C123513 | C5H12O | 88.1 | 733.1 | 176.855 | 1.49745 | |
| 43 | 3-hydroxybutan-2-one | C513860 | C4H8O2 | 88.1 | 710.5 | 167.878 | 1.33205 | |
| 44 | Methyl butyrate | C623427 | C5H10O2 | 102.1 | 694.5 | 161.557 | 1.43472 | |
| 45 | 3-methylbutanal | C590863 | C5H10O | 86.1 | 647.9 | 147.532 | 1.1958 | |
| 46 | 2-methyl-1-propanol | C78831 | C4H10O | 74.1 | 620.7 | 139.725 | 1.17089 | |
| 47 | Butanal | C123728 | C4H8O | 72.1 | 556.7 | 121.362 | 1.27974 | |
| 48 | 2-Butanone | C78933 | C4H8O | 72.1 | 586.5 | 129.893 | 1.24377 | |
| 49 | 1-propene-3-methylthio | C10152768 | C4H8S | 88.2 | 682.2 | 157.364 | 1.0399 | |
| 50 | Ethyl Acetate | C141786 | C4H8O2 | 88.1 | 604.6 | 135.098 | 1.33325 | |
| 51 | 2-methylbutan-1-ol | C137326 | C5H12O | 88.1 | 747.7 | 182.666 | 1.47347 | |
| 52 | 2-methyl-2-butenal | C1115113 | C5H8O | 84.1 | 744.4 | 181.365 | 1.42826 | |
| 53 | 5-methylfurfural | C620020 | C6H6O2 | 110.1 | 967.1 | 317.751 | 1.1267 | |
| 54 | 2-heptanone | C110430 | C7H14O | 114.2 | 890.9 | 254.717 | 1.25824 | |
| 55 | Ethyl 2-methylbutyrate | C7452791 | C7H14O2 | 130.2 | 843.4 | 229.121 | 1.65051 | |
| 56 | 2-Acetylfuran-D | C1192627 | C6H6O2 | 110.1 | 912.8 | 272.586 | 1.44357 | Dimer |
| 57 | Ethyl phenylacetate | C101973 | C10H12O2 | 164.2 | 1239.1 | 687.359 | 1.30522 | |
| 58 | 3-Methyl-3-buten-1-ol | C763326 | C5H10O | 86.1 | 723.7 | 173.145 | 1.24758 | |
| 59 | γ-Octalactone | C104507 | C8H14O2 | 142.2 | 1279 | 744.06 | 1.34069 | |
| 60 | Citronellol | C106229 | C10H20O | 156.3 | 1238.6 | 686.629 | 1.36257 |