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2H-1,4-Benzoxazine-2-carboxylic acid, 3,4-dihydro-3-thioxo-, ethyl ester
SpectraBase Compound ID KY6GzUXxcMC
InChI InChI=1S/C11H11NO3S/c1-2-14-11(13)9-10(16)12-7-5-3-4-6-8(7)15-9/h3-6,9H,2H2,1H3,(H,12,16)
InChIKey FEVHYVYPOLMNQV-UHFFFAOYSA-N
Mol Weight 237.27 g/mol
Molecular Formula C11H11NO3S
Exact Mass 237.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENuBmS42C2V
Name 2H-1,4-Benzoxazine-2-carboxylic acid, 3,4-dihydro-3-thioxo-, ethyl ester
CAS Registry Number 121583-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO3S
InChI InChI=1S/C11H11NO3S/c1-2-14-11(13)9-10(16)12-7-5-3-4-6-8(7)15-9/h3-6,9H,2H2,1H3,(H,12,16)
InChIKey FEVHYVYPOLMNQV-UHFFFAOYSA-N
Molecular Weight 237.273 g/mol
SMILES N1c2c(OC(C1=S)C(=O)OCC)cccc2
SPLASH splash10-08mr-0960000000-e1b465c3f721c7b99ed7
Source of Spectrum AH-119-1442-9
Synonyms Ethyl 3,4-dihydro-3-thioxo-2H-1,4-benzoxazin-2-carboxylate Ethyl 3-thioxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Wiley ID 1239343