Human Metabolome Database: 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) (HMDB0001175)

Spectrum Details

HMDB ID:	HMDB0001175
Compound name:	Malonyl-CoA
Spectrum type:	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)

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Malonyl-CoA

Assignment Table
Row No.	Cluster Midpoint	No. Peaks	Coupling Type	No. H's	Atom No.		Peak Centers (ppm)
1	8.49	1	s	1	69	+	8.49
2	8.14	1	s	1	72	+	8.14
3	6.10	2	s	1	68	+	6.126.08
4	4.37	8	ddd	1	75	+	4.404.394.384.374.374.364.354.34
5	4.37	2	d	1	73	+	4.384.37
6	4.25	4	dd	2	65 66	+	4.274.254.254.23
7	4.19	2	d	2	61 62	+	4.204.18
8	4.12	6	dt	1	67	+	4.154.144.124.124.104.09
9	3.98	1	s	1	78	+	3.98
10	3.85	1	s	2	90 91	+	3.85
11	3.43	5	dt	1	81	+	3.473.453.433.413.39
12	3.20	6	dt	1	87	+	3.243.223.203.203.183.16
13	3.18	6	dt	1	86	+	3.223.203.183.183.163.14
14	2.81	3	t	2	88 89	+	2.832.812.79
15	2.81	6	dt	1	84	+	2.862.832.812.812.792.76
16	2.41	5	dt	1	82	+	2.452.432.412.392.37
17	2.25	6	dt	1	83	+	2.302.272.252.252.232.20
18	0.92	1	s	3	55 56 57	+	0.92
19	0.88	1	s	3	58 59 60	+	0.88

Experimental Conditions

Solvent:	D₂O
Nucleus:	¹H
Frequency:	300 MHz

Documentation

Document Description	Download	File Size
Peak List (TXT)	Download file	4.76 KB
Peak Assignments (TXT)	Download file	1.21 KB
Spectra Image with Peak Assignments	Not Available	Not Available
Raw Spectrum Image	Not Available	Not Available
nmrML File (NMRML)	Download file	292 KB
JCAMP-DX File (JDX)	Download file	90.6 KB
Raw Free Induction Decay file for spectral processing	Not Available	Not Available
Validation Report	Not Available	Not Available

References

Not Available