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N-Methyl-4-methoxy-4,7-(vinylene)-1-thioxoperhydroisoindol-3-one
SpectraBase Compound ID 4hRgclCImBy
InChI InChI=1S/C12H15NO2S/c1-13-10(14)9-8(11(13)16)7-3-5-12(9,15-2)6-4-7/h3,5,7-9H,4,6H2,1-2H3/t7?,8-,9+,12?/m0/s1
InChIKey UOAZWJOYYYJXQE-WAYSKOFRSA-N
Mol Weight 237.32 g/mol
Molecular Formula C12H15NO2S
Exact Mass 237.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Mq2WD1ZFqC
Name N-Methyl-4-methoxy-4,7-(vinylene)-1-thioxoperhydroisoindol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO2S
InChI InChI=1S/C12H15NO2S/c1-13-10(14)9-8(11(13)16)7-3-5-12(9,15-2)6-4-7/h3,5,7-9H,4,6H2,1-2H3/t7?,8-,9+,12?/m0/s1
InChIKey UOAZWJOYYYJXQE-WAYSKOFRSA-N
Molecular Weight 237.317 g/mol
SMILES C1(N(C([C@]2(C3C=CC([C@@]12[H])(CC3)OC)[H])=S)C)=O
SPLASH splash10-03di-0940000000-17d99d6a49eb15232037
Source of Spectrum J-57-3990-12
Synonyms (2S,6S)-1-Methoxy-4-methyl-5-thioxo-4-aza-tricyclo[5.2.2.0*2,6*]undec-8-en-3-one 1-Methoxy-4-methyl-5-thioxo-4-azatricyclo[5.2.2.0(2,6)]undec-8-en-3-one
Wiley ID 1239416