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(2Z)-2-(3-keto-4H-1,4-benzothiazin-2-ylidene)acetic acid
SpectraBase Compound ID A94yNEFapmn
InChI InChI=1S/C10H7NO3S/c12-9(13)5-8-10(14)11-6-3-1-2-4-7(6)15-8/h1-5H,(H,11,14)(H,12,13)/b8-5-
InChIKey WAYRLQOFJVUVCD-YVMONPNESA-N
Mol Weight 221.23 g/mol
Molecular Formula C10H7NO3S
Exact Mass 221.014664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ij6zj0HVrA7
Name (2Z)-2-(3-keto-4H-1,4-benzothiazin-2-ylidene)acetic acid
CAS Registry Number 106660-02-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7NO3S
InChI InChI=1S/C10H7NO3S/c12-9(13)5-8-10(14)11-6-3-1-2-4-7(6)15-8/h1-5H,(H,11,14)(H,12,13)/b8-5-
InChIKey WAYRLQOFJVUVCD-YVMONPNESA-N
Molecular Weight 221.230 g/mol
SMILES N1c2c(S\C(=C/C(=O)O)C1=O)cccc2
SPLASH splash10-00fr-0690000000-28e0c919526c25c8e9cb
Source of Spectrum B-39-507-3
Synonyms (2Z)-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)ethanoic acid (2Z)-2-(3-oxo-4H-1,4-benzothiazin-2-ylidene)acetic acid
Wiley ID 1221070