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6-Azulenecarbothioic acid S-methyl ester
SpectraBase Compound ID GQ0zlzxrfI7
InChI InChI=1S/C12H10OS/c1-14-12(13)11-7-5-9-3-2-4-10(9)6-8-11/h2-8H,1H3
InChIKey XSMSZEBWXULJEP-UHFFFAOYSA-N
Mol Weight 202.27 g/mol
Molecular Formula C12H10OS
Exact Mass 202.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4m1jKx0MfaQ
Name 6-Azulenecarbothioic acid S-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10OS
InChI InChI=1S/C12H10OS/c1-14-12(13)11-7-5-9-3-2-4-10(9)6-8-11/h2-8H,1H3
InChIKey XSMSZEBWXULJEP-UHFFFAOYSA-N
Molecular Weight 202.271 g/mol
SMILES c1(C(=O)SC)ccc2cccc2cc1
SPLASH splash10-004i-0920000000-5e167eafeda2c2861201
Source of Spectrum SO-0-1348-5
Synonyms azulene-6-carbothioic acid S-methyl ester S-methyl azulene-6-carbothioate
Wiley ID 878537