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1H-Phosphole-2-carboxylic acid, 3,4-dimethyl-1-phenyl-, 1-sulfide
SpectraBase Compound ID 1kLN86jZja1
InChI InChI=1S/C13H13O2PS/c1-9-8-16(17,11-6-4-3-5-7-11)12(10(9)2)13(14)15/h3-8H,1-2H3,(H,14,15)
InChIKey KJEIAMZENSVWIH-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H13O2PS
Exact Mass 264.037388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B13tV35I6DY
Name 1H-Phosphole-2-carboxylic acid, 3,4-dimethyl-1-phenyl-, 1-sulfide
CAS Registry Number 50485-90-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13O2PS
InChI InChI=1S/C13H13O2PS/c1-9-8-16(17,11-6-4-3-5-7-11)12(10(9)2)13(14)15/h3-8H,1-2H3,(H,14,15)
InChIKey KJEIAMZENSVWIH-UHFFFAOYSA-N
Molecular Weight 264.279 g/mol
SMILES OC(C=1P(C=C(C)C1C)(=S)c1ccccc1)=O
SPLASH splash10-05g3-3930000000-292f6d2715a83529f068
Source of Spectrum F-30-3131-11
Synonyms 3,4-Dimethyl-1-phenyl-1-sulfanylidene-1$l^{5}-phosphole-2-carboxylic acid
Wiley ID 1267656