Table 3. ¹H, ¹³C{¹H}, and ¹⁵N NMR Data of (1H-Indazol-1-yl)Methanol Derivatives in DMSO-d₆ Solution^a.

	2ab	2b	3b	2c	2d	1e–2H	2e	3e
nuclei	H	4-NO2	4-NO2	5-NO2	6-NO2	7-NO2	7-NO2	7-NO2
1H (ppm)
H3	8.09	8.54	8.91	8.42	8.34	8.43	8.30	8.85
H4	7.72	NO2	NO2	8.83	8.03	8.33e	8.19	8.37
H5	7.17	8.20	8.21	NO2	7.99	7.37	7.38	7.28
H6	7.41	7.68	7.40	8.27	NO2	8.36e	8.28	8.48
H7	7.77	8.27	8.30	7.92	8.78	NO2	NO2	NO2
CH2	5.73	5.79	5.79	5.78	5.86		5.83	5.80
OH	6.68	6.95	7.50	6.94	6.93		6.59	7.48
13C (ppm)
C3	134.2	132.1	124.8	136.4	134.0	136.2	135.5	120.4
C3a	126.0	116.6	113.9	123.3	127.4	127.6	130.6g	125.7
C4	121.6	140.6	143.0	118.9	122.2	130.4	128.8	126.7
C5	121.7	118.7	120.7	141.4	115.3	120.7	121.3	120.4
C6	127.0	126.0	123.8	121.0	145.9	124.0	124.8	125.7
C7	111.0	118.3	126.6	112.0	107.2	132.6f	138.2g	137.4
C7a	139.8	139.7	149.2	140.8	137.6	132.4f	130.8g	140.1
CH2	71.6	71.5	75.8	71.4	71.4		75.3	76.2
15N (ppm)
N1	–180.8b	–173.7	–90.2	–174.3	–173.0		–170.1	–86.5
N2	–60.5b	–50.6	–134.2	–50.3	–45.2		–47.7	–134.5
NO2		–15.6	–15.9	–17.1	–16.6		–13.9	–17.4
SSCC (Hz)
3JCH2OH	–7.3c	–7.5c	–8.0c	–7.5c	–7.4c		–7.7c	–7.9c
3JH4H5	8.5	NO2	NO2	NO2	8.8	7.9	7.9	8.2
3JH5H6	7.5	7.3	7.7	NO2	NO2	7.9	7.9	7.5
3JH6H7	8.0	7.6	8.4	9.2	NO2	7.9	NO2	NO2
4JH4H6	1.0	NO2	NO2	2.2	NO2	0.9	1.0	1.0
4JH5H7	0.9	0.9	d	NO2	1.5	NO2	NO2	NO2
5JH3H7	0.8d	0.9	0.0	1.0	0.0	NO2	NO2	NO2

^aItalic type: predicted values.

^bFrom ref (17): ³J_N1H3 = 7.9, ²J_N2H3 = 13.0, ³J_N2CH2 = 2.7 Hz;¹⁷ calculated, this work, ³J_N1H3 = 5.5, ²J_N2H3 = 9.2, ³J_N2CH2 = 2.0 Hz.

^cThe minus sign was assigned from the calculations.

^dNot measured.

^eAssignment based on coupling constants (Figure 5).

^fFrom ref (47).

^gNot observed.