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[(3-Nitro-2-pyridinyl)sulfanyl]acetic acid
SpectraBase Compound ID ACLqrOc4EGV
InChI InChI=1S/C7H6N2O4S/c10-6(11)4-14-7-5(9(12)13)2-1-3-8-7/h1-3H,4H2,(H,10,11)
InChIKey WBPUHBNGHSAAGT-UHFFFAOYSA-N
Mol Weight 214.19 g/mol
Molecular Formula C7H6N2O4S
Exact Mass 214.004828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8WheNIWD3A
Name [(3-Nitro-2-pyridinyl)sulfanyl]acetic acid
CAS Registry Number 18504-80-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N2O4S
InChI InChI=1S/C7H6N2O4S/c10-6(11)4-14-7-5(9(12)13)2-1-3-8-7/h1-3H,4H2,(H,10,11)
InChIKey WBPUHBNGHSAAGT-UHFFFAOYSA-N
Molecular Weight 214.195 g/mol
SMILES OC(CSc1c(N(=O)=O)cccn1)=O
SPLASH splash10-0kbf-9500000000-6316b19498eefc5ec2cc
Source of Spectrum AD-0-2532-0
Synonyms 2-(3-nitropyridin-2-yl)sulfanylacetic acid 2-(3-nitropyridin-2-yl)sulfanylethanoic acid 2-[(3-nitro-2-pyridinyl)thio]acetic acid 2-[(3-nitro-2-pyridyl)sulfanyl]acetic acid 2-[(3-nitro-2-pyridyl)thio]acetic acid 3-Nitropyrid-2-ylthioacetic acid Acetic acid, (3-nitro-2-pyridyl)thio-
Wiley ID 1427515