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Benzo[c]thiophen-4(1H)-one, 1,3-diethylhexahydro-
SpectraBase Compound ID GCTknfqo2k
InChI InChI=1S/C12H20OS/c1-3-10-8-6-5-7-9(13)12(8)11(4-2)14-10/h8,10-12H,3-7H2,1-2H3
InChIKey CKDBRLFZBDGZEB-UHFFFAOYSA-N
Mol Weight 212.35 g/mol
Molecular Formula C12H20OS
Exact Mass 212.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7eSwNFECFPJ
Name Benzo[c]thiophen-4(1H)-one, 1,3-diethylhexahydro-
CAS Registry Number 87562-90-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20OS
InChI InChI=1S/C12H20OS/c1-3-10-8-6-5-7-9(13)12(8)11(4-2)14-10/h8,10-12H,3-7H2,1-2H3
InChIKey CKDBRLFZBDGZEB-UHFFFAOYSA-N
Molecular Weight 212.351 g/mol
SMILES C1(SC(C2CCCC(C12)=O)CC)CC
SPLASH splash10-001i-0920000000-1bd9f1fd49eedaa5f5bc
Source of Spectrum KC-1983-1247-0
Synonyms 1,3-Diethyl-1,3,3a,6,7,7a-hexahydrobenzo[c]thiophen-4(5H)-one 1,3-Diethylhexahydro-2-benzothiophen-4(1H)-one
Wiley ID 1211429