Table 4.

Identification features of the suspect analytes.

Compound	Molecular Formula	Experimental tR (min)	Quantifier ion (m/z)	Qualifier ion (I) (m/z)	Qualifier ion (II) (m/z)	RI experimental	RI literature
2,5-Dimethyl furan	C6H8O	6.99	96	95	43	725	–
Octene	C8H16	8.48	41	56	57	795	–
3-Hepten-2-one	C7H12O	8.85	55	97	43	814	–
Prenol	C5H10O	9.13	71	41	86	828	–
2,3-Butanediol	C4H10O2	10.07	45	43	57	875	882 [22]
3-Furaldehyde	C5H4O2	10.64	95	96	39	903	905 [22]
3-methylbutanoic acid	C5H10O2	11.11	60	43	41	928	920 [22]
2-Furanmethanol	C5H6O2	11.17	98	81	41	932	–
α-Pinene	C10H16	11.54	93	92	77	952	948 [27]
Methyl hexanoate	C7H14O2	11.58	74	87	99	954	–
Furan-2-pentyl	C9H14O	12.66	81	82	138	1010	1006 [27]
1-octen-3-ol	C8H16O	12.90	57	72	43	1022	1025 [28]
6-Methyl-5-hepten-2-one	C8H14O	13.12	43	69	108	1032	–
Limonene	C10H16	13.41	68	93	79	1046	1048 [27]
β-Isophorone	C9H14O	14.65	81	96	95	1104	–
Benzeneacetaldehyde	C8H8O	15.06	91	92	120	1117	1123 [22]
2-Nonanone	C9H18O	15.66	43	58	57	1136	1140 [28]
Acetophenone	C8H8O	15.71	105	77	51	1138	–
Linalool	C10H18O	15.81	71	43	41	1141	1151 [22]
Methyl octanoate	C9H18O2	16.02	74	87	127	1148	–
Methyl benzoate	C8H8O2	16.07	105	77	136	1149	–
Hotrienol	C10H16O	16.19	71	43	82	1153	1161 [22]
Phenylethyl alcohol	C8H10O	17.6	91	92	122	1198	1120 [22]
Lilac aldehyde (Isomer)	C10H16O2	18.23	55	43	67	1225	–
Ethyl benzoate	C9H10O2	18.57	105	77	68	1239	–
Dill ether	C10H16O	18.87	137	109	67	1251	–
Methyl nonanoate	C10H20O2	19.28	74	87	43	1268	–
Myrtenol	C10H16O	19.77	79	91	107	1289	–
4-Methoxybenzaldehyde	C8H8O2	21.75	135	136	77	1365	–
2-Aminoacetophenone	C8H9NO	22.78	120	135	92	1407	–
Methyl anthranilate	C8H9NO2	23.41	119	92	151	1443	–