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(3,4-Dimethyl-5-thioxo-1,5-dihydropyrrol-2-ylidene)-acetic acid, t-butyl ester
SpectraBase Compound ID 4sMKnVARi7z
InChI InChI=1S/C12H17NO2S/c1-7-8(2)11(16)13-9(7)6-10(14)15-12(3,4)5/h6H2,1-5H3
InChIKey RZXKYRDYYMHLNG-UHFFFAOYSA-N
Mol Weight 239.33 g/mol
Molecular Formula C12H17NO2S
Exact Mass 239.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlmdNAuD9BG
Name (3,4-Dimethyl-5-thioxo-1,5-dihydropyrrol-2-ylidene)-acetic acid, t-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO2S
InChI InChI=1S/C12H17NO2S/c1-7-8(2)11(16)13-9(7)6-10(14)15-12(3,4)5/h6H2,1-5H3
InChIKey RZXKYRDYYMHLNG-UHFFFAOYSA-N
Molecular Weight 239.333 g/mol
SMILES CC(OC(CC=1C(=C(C)C(N1)=S)C)=O)(C)C
SPLASH splash10-014i-3910000000-29c33f9ec5ff52ac64c6
Synonyms (3,4-dimethyl-5-thioxo-1,5-dihydro-pyrrol-2-ylidene)-acetic acid tert-butyl ester tert-Butyl (2E)-(3,4-dimethyl-5-thioxo-1,5-dihydro-2H-pyrrol-2-ylidene)ethanoate tert-Butyl (3,4-dimethyl-2-thioxo-2H-pyrrol-5-yl)acetate
Wiley ID 1481990