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homocysteine, S-methyl-N-[3-methyl-2-[[(4-methylcyclohexyl)carbonyl]amino]-1-oxobutyl]-, methyl ester
SpectraBase Compound ID LP8E0NBcrhO
InChI InChI=1S/C19H34N2O4S/c1-12(2)16(21-17(22)14-8-6-13(3)7-9-14)18(23)20-15(10-11-26-5)19(24)25-4/h12-16H,6-11H2,1-5H3,(H,20,23)(H,21,22)/t13-,14-,15?,16?
InChIKey HTSWWJFXGODIMJ-MSBXVQKDSA-N
Mol Weight 386.6 g/mol
Molecular Formula C19H34N2O4S
Exact Mass 386.223929 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Su4JvOlEO8
Name homocysteine, S-methyl-N-[3-methyl-2-[[(4-methylcyclohexyl)carbonyl]amino]-1-oxobutyl]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.223928753 u
Formula C19H34N2O4S
InChI InChI=1S/C19H34N2O4S/c1-12(2)16(21-17(22)14-8-6-13(3)7-9-14)18(23)20-15(10-11-26-5)19(24)25-4/h12-16H,6-11H2,1-5H3,(H,20,23)(H,21,22)/t13-,14-,15?,16?
InChIKey HTSWWJFXGODIMJ-MSBXVQKDSA-N
Molecular Weight 386.551 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4706
Solvent ACETONE-d6
Source Vendor ID: NMR/13288393