Cannabis Compound Database: 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) (CDB000178)

Spectrum Details

CDB ID:	CDB000178
Compound name:	alpha-Linolenic acid
Spectrum type:	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)

Spectrum View

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MMDBc0000190

Assignment Table
Row No.	Cluster Midpoint	No. Peaks	Coupling Type	No. H's	Atom No.		Peak Centers (ppm)
1	5.52	18	dt	1	27	+	5.355.415.435.445.465.475.485.505.525.545.545.555.585.595.615.655.655.66
2	5.52	16	dt	2	30 31	+	5.365.375.435.445.475.485.495.515.545.545.565.585.605.625.655.67
3	5.51	16	dt	1	34	+	5.345.415.425.445.455.475.485.495.525.545.555.585.595.605.655.66
4	5.39	17	dt	1	26	+	5.265.275.275.295.315.335.345.375.385.405.425.445.455.465.495.515.57
5	5.39	16	dt	1	35	+	5.255.265.285.315.325.335.365.375.395.425.435.445.465.495.505.57
6	2.46	45	t	2	28 29	+	2.522.542.572.642.202.242.262.282.292.302.312.312.332.352.352.362.382.392.402.402.412.422.432.442.452.462.472.472.492.492.502.512.522.532.542.552.572.592.592.602.602.622.642.662.70
7	2.46	43	t	2	32 33	+	2.622.642.192.232.252.282.292.302.312.322.352.362.362.382.392.392.402.412.422.422.432.442.452.462.472.472.482.492.492.502.512.522.532.542.552.582.592.602.602.622.642.672.71
8	2.32	13	t	2	48 49	+	2.242.362.372.372.552.122.232.242.302.312.362.372.37
9	2.05	14	m	2	24 25	+	1.921.992.062.071.921.921.992.002.062.072.132.142.202.21
10	1.98	38	dt	2	36 37	+	1.761.801.831.871.871.911.942.002.012.142.142.251.741.791.801.831.871.901.901.911.931.941.961.971.982.002.012.032.052.062.082.102.112.142.142.172.212.21
11	1.44	58	tt	2	46 47	+	1.181.251.261.281.291.301.311.331.341.351.361.381.381.411.431.441.451.491.491.501.511.511.521.551.561.571.631.631.201.231.241.281.321.341.351.371.401.401.411.431.441.451.461.491.491.501.511.521.551.561.581.591.611.621.631.631.691.70
12	1.34	50	tt	2	38 39	+	1.141.181.201.231.241.271.281.281.311.311.331.341.341.351.381.401.411.411.441.451.501.131.141.181.201.201.241.241.271.281.281.301.311.331.341.351.371.381.391.411.411.431.441.451.461.481.491.501.521.58
13	1.29	68	m	2	40 41	+	1.061.071.091.111.121.141.151.161.171.191.191.211.211.221.241.241.251.251.271.281.291.301.321.331.331.341.361.371.391.401.411.421.431.441.451.491.501.091.111.121.151.151.171.191.211.221.241.251.271.281.291.301.301.331.331.341.361.371.391.401.411.421.431.451.471.481.481.49
14	1.28	59	m	2	44 45	+	1.071.071.091.121.131.141.161.181.201.201.221.231.251.261.281.301.311.331.341.371.381.401.401.411.421.541.091.091.111.121.121.151.181.201.201.221.231.251.261.271.271.281.301.311.331.331.341.371.391.401.401.421.421.431.451.461.461.481.54
15	1.27	63	m	2	42 43	+	1.111.141.151.151.161.181.191.211.231.231.251.261.271.281.291.291.301.311.321.351.361.371.381.381.391.401.401.441.451.461.061.071.081.091.111.121.141.151.151.161.171.191.201.221.231.231.251.261.261.271.291.291.311.321.351.361.371.381.391.411.421.451.45
16	0.97	18	t	3	21 22 23	+	0.900.970.971.040.890.900.900.970.971.041.040.890.900.960.971.041.041.04

Experimental Conditions

Solvent:	H₂O
Nucleus:	¹H
Frequency:	100 MHz

Documentation

Document Description	Download	File Size
Peak List (TXT)	Download file	36.7 KB
Peak Assignments (TXT)	Download file	883 Bytes
Spectra Image with Peak Assignments	Not Available	Not Available
Raw Spectrum Image	Not Available	Not Available
nmrML File (NMRML)	Download file	601 KB
JCAMP-DX File (JDX)	Download file	205 KB
Raw Free Induction Decay file for spectral processing	Not Available	Not Available
Validation Report	Not Available	Not Available

References

Not Available