For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Acetic acid, 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]-
SpectraBase Compound ID 3kOvF5NjACg
InChI InChI=1S/C11H12N2O3S/c1-7-3-8(5-16-2)9(4-12)11(13-7)17-6-10(14)15/h3H,5-6H2,1-2H3,(H,14,15)
InChIKey MJLLTDZSIPEIAO-UHFFFAOYSA-N
Mol Weight 252.29 g/mol
Molecular Formula C11H12N2O3S
Exact Mass 252.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IZmAffuthRK
Name Acetic acid, 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O3S
InChI InChI=1S/C11H12N2O3S/c1-7-3-8(5-16-2)9(4-12)11(13-7)17-6-10(14)15/h3H,5-6H2,1-2H3,(H,14,15)
InChIKey MJLLTDZSIPEIAO-UHFFFAOYSA-N
Molecular Weight 252.288 g/mol
SMILES OC(CSc1c(c(cc(C)n1)COC)C#N)=O
SPLASH splash10-0007-9710000000-c26536faba9449972955
Source of Spectrum IY-1-4318-6
Synonyms 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]thio]acetic acid 2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]sulfanylacetic acid 2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]sulfanyl]acetic acid 2-[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]sulfanylethanoic acid
Wiley ID 1651169