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Carbamic acid, [2-(1-hexenylthio)-1-(hydroxymethyl)ethyl]-, methyl ester, [R-(E)]-
SpectraBase Compound ID CFUZmCNjB9w
InChI InChI=1S/C11H21NO3S/c1-3-4-5-6-7-16-9-10(8-13)12-11(14)15-2/h6-7,10,13H,3-5,8-9H2,1-2H3,(H,12,14)/b7-6+/t10-/m1/s1
InChIKey OMMZHPWZZIWJEY-VQCYPWCPSA-N
Mol Weight 247.35 g/mol
Molecular Formula C11H21NO3S
Exact Mass 247.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84HHYnCBCtU
Name Carbamic acid, [2-(1-hexenylthio)-1-(hydroxymethyl)ethyl]-, methyl ester, [R-(E)]-
CAS Registry Number 76247-83-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H21NO3S
InChI InChI=1S/C11H21NO3S/c1-3-4-5-6-7-16-9-10(8-13)12-11(14)15-2/h6-7,10,13H,3-5,8-9H2,1-2H3,(H,12,14)/b7-6+/t10-/m1/s1
InChIKey OMMZHPWZZIWJEY-VQCYPWCPSA-N
Molecular Weight 247.353 g/mol
SMILES N(C(=O)OC)[C@](CO)(CS\C=C\CCCC)[H]
SPLASH splash10-00kr-7910000000-2d64f05da2e7055347a6
Source of Spectrum F-43-4894-3
Synonyms Methyl (1R)-2-[(1E)-1-hexenylsulfanyl]-1-(hydroxymethyl)ethylcarbamate [2r(5E)]-3-(1-hexen-1-ylthio)-2-[(methoxycarbonyl)amino]propano]
Wiley ID 1249811