MiMeDB: 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) (MMDBc0032030)

Spectrum Details

MiMe ID:	MMDBc0032030
Compound name:	LPA(18:1(9Z)/0:0)
Spectrum type:	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)

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MMDBc0032030

Multiplets	❮ ❯ 5.34 4.20 4.16 3.91 2.32 2.02 2.02 1.57 1.31 1.30 1.29 1.29 1.27 1.27 1.27 1.27 1.27 1.26 0.88

Assignment Table
Row No.	Cluster Midpoint	No. Peaks	Coupling Type	No. H's	Atom No.		Peak Centers (ppm)
1	5.34	15	dt	2	47 48	+	5.315.315.325.335.335.335.345.345.355.355.355.355.365.375.37
2	4.20	2	d	2	63 64	+	4.194.21
3	4.16	4	dd	2	67 68	+	4.154.164.164.17
4	3.91	10	m	1	65	+	3.883.893.903.903.913.913.923.923.933.93
5	2.32	3	t	2	61 62	+	2.312.322.33
6	2.02	24	dt	2	49 50	+	1.971.981.991.992.002.002.002.012.012.012.022.022.022.022.032.032.042.042.042.052.062.062.062.07
7	2.02	24	dt	2	45 46	+	1.971.981.991.992.002.002.002.012.012.012.022.022.022.022.032.032.042.042.042.052.062.062.062.07
8	1.57	5	tt	2	59 60	+	1.541.561.571.581.60
9	1.31	40	tt	2	43 44	+	1.271.281.281.281.281.291.301.301.311.311.321.331.271.281.281.281.281.291.291.291.301.301.301.301.301.311.311.311.311.321.321.321.321.331.331.341.341.341.351.35
10	1.30	43	tt	2	51 52	+	1.271.271.281.281.281.291.291.301.301.311.331.331.271.281.281.281.281.281.281.291.291.291.301.301.301.301.301.311.311.311.311.311.321.321.321.321.331.331.341.341.341.351.35
11	1.29	58	m	2	53 54	+	1.251.251.251.261.261.261.261.271.271.271.271.281.281.281.291.291.291.301.301.301.311.321.331.331.341.251.251.261.261.271.271.271.281.281.281.281.291.291.291.291.301.301.301.301.301.311.311.311.311.321.321.321.321.331.331.331.331.34
12	1.29	52	m	2	41 42	+	1.261.261.271.271.271.281.281.281.291.291.291.301.301.311.311.321.331.251.261.261.261.261.261.271.271.271.271.281.281.281.281.291.291.291.291.291.301.301.301.301.301.311.311.311.321.321.321.321.331.331.331.34
13	1.27	58	m	2	33 34	+	1.221.241.251.251.251.261.261.261.261.271.271.271.271.281.281.281.281.291.291.291.301.301.301.311.311.321.221.231.231.241.241.251.251.251.251.251.261.261.261.261.271.271.271.281.281.281.281.281.291.291.291.291.291.301.301.311.311.32
14	1.27	61	m	2	39 40	+	1.221.221.231.231.231.231.241.241.241.251.251.261.261.281.281.281.291.301.301.301.301.311.311.311.221.231.231.231.241.241.241.241.251.251.251.251.251.261.261.261.271.271.271.271.271.281.281.281.281.291.291.291.291.301.301.301.311.311.311.311.32
15	1.27	69	m	2	55 56	+	1.231.231.231.241.251.251.251.261.261.261.261.261.271.271.271.271.271.281.281.281.281.291.291.291.291.301.301.301.311.311.311.311.321.211.221.221.221.231.231.231.231.241.241.251.251.251.251.261.261.261.261.271.271.271.271.271.271.281.281.281.291.291.291.301.301.301.301.311.32
16	1.27	55	m	2	37 38	+	1.241.251.251.251.251.261.261.261.261.271.271.281.281.281.281.281.291.291.291.291.291.301.301.301.221.221.231.231.231.231.241.241.241.251.251.251.261.261.261.261.261.271.271.271.281.281.281.291.291.291.291.291.301.301.30
17	1.27	51	tt	2	35 36	+	1.231.231.231.241.241.241.251.251.261.261.261.271.271.281.281.281.281.291.291.291.301.301.231.231.241.241.251.251.251.251.251.261.261.261.261.271.271.271.281.281.281.281.281.291.291.291.291.301.301.311.31
18	1.26	64	m	2	57 58	+	1.211.221.221.231.231.231.231.241.241.241.251.251.251.251.261.261.261.261.271.271.271.271.281.281.281.281.291.291.291.301.301.311.311.221.231.231.241.241.241.251.251.251.251.251.261.261.261.261.271.271.271.271.281.281.281.281.291.291.301.301.301.301.311.31
19	0.88	39	t	3	30 31 32	+	0.850.870.880.880.890.900.910.920.850.850.870.870.870.870.870.880.880.890.890.910.840.850.860.870.870.870.880.880.880.890.890.890.890.890.900.910.910.910.92

Experimental Conditions

Solvent:	H₂O
Nucleus:	¹H
Frequency:	500 MHz

Documentation

Document Description	Download	File Size
Peak List (TXT)	Download file	47.1 KB
Peak Assignments (TXT)	Download file	1.15 KB
Spectra Image with Peak Assignments	Not Available	Not Available
Raw Spectrum Image	Not Available	Not Available
nmrML File (NMRML)	Download file	614 KB
JCAMP-DX File (JDX)	Download file	210 KB
Raw Free Induction Decay file for spectral processing	Not Available	Not Available
Validation Report	Not Available	Not Available

References

Not Available

¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted) (MMDBc0032030)

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