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Methyl 4-nitro-3-(tosylmethyl)butanoate
SpectraBase Compound ID DWim91Ea1iN
InChI InChI=1S/C13H17NO6S/c1-10-3-5-12(6-4-10)21(18,19)9-11(8-14(16)17)7-13(15)20-2/h3-6,11H,7-9H2,1-2H3
InChIKey WNPZYPSDTGBACX-UHFFFAOYSA-N
Mol Weight 315.34 g/mol
Molecular Formula C13H17NO6S
Exact Mass 315.077658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GU1vQg8mOgY
Name Methyl 4-nitro-3-(tosylmethyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO6S
InChI InChI=1S/C13H17NO6S/c1-10-3-5-12(6-4-10)21(18,19)9-11(8-14(16)17)7-13(15)20-2/h3-6,11H,7-9H2,1-2H3
InChIKey WNPZYPSDTGBACX-UHFFFAOYSA-N
Molecular Weight 315.340 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(CN(=O)=O)CC(=O)OC
SPLASH splash10-052f-9400000000-8c5ee12c17169d7336ef
Source of Spectrum F-52-15254-16
Synonyms Methyl 4-[(4-methylphenyl)sulfonyl]-3-(nitromethyl)butanoate
Wiley ID 799683