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Dibenzo[c,e]thiepin, 5,7-dihydro-1,11-dimethyl-
SpectraBase Compound ID APE9CULkctu
InChI InChI=1S/C16H16S/c1-11-5-3-7-13-9-17-10-14-8-4-6-12(2)16(14)15(11)13/h3-8H,9-10H2,1-2H3
InChIKey NKZODJXFMWXHNM-UHFFFAOYSA-N
Mol Weight 240.36 g/mol
Molecular Formula C16H16S
Exact Mass 240.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20Zyu8UAzro
Name Dibenzo[c,e]thiepin, 5,7-dihydro-1,11-dimethyl-
CAS Registry Number 27720-88-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16S
InChI InChI=1S/C16H16S/c1-11-5-3-7-13-9-17-10-14-8-4-6-12(2)16(14)15(11)13/h3-8H,9-10H2,1-2H3
InChIKey NKZODJXFMWXHNM-UHFFFAOYSA-N
Molecular Weight 240.364 g/mol
SMILES Cc1c2-c3c(cccc3C)CSCc2ccc1
SPLASH splash10-0006-0980000000-33588a7518760c56fb87
Source of Spectrum O3-0-1349-0
Synonyms 1,11-Dimethyl-5,7-dihydrodibenzo[c,E]thiepine 1,11-dimethyl-5,7-dihydrobenzo[d][2]benzothiepin 1,11-dimethyl-5,7-dihydrobenzo[d][2]benzothiepine 1,11-dimethyl-5,7-dihydrodibenzo[c,e]thiepin
Wiley ID 1243549