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2,4-Dichloro-5-phenyl-2,3-dihydro-1-benzothiepin

View entire compound with spectra: 1 MS (GC)

2,4-Dichloro-5-phenyl-2,3-dihydro-1-benzothiepin
SpectraBase Compound ID AyIkxL2wHEQ
InChI InChI=1S/C16H12Cl2S/c17-13-10-15(18)19-14-9-5-4-8-12(14)16(13)11-6-2-1-3-7-11/h1-9,15H,10H2
InChIKey HVEKCSXWPGRZQT-UHFFFAOYSA-N
Mol Weight 307.24 g/mol
Molecular Formula C16H12Cl2S
Exact Mass 306.003677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5a1n7QO57mv
Name 2,4-Dichloro-5-phenyl-2,3-dihydro-1-benzothiepin
Alternate Name(s) 2,4-Dichloro-5-phenyl-2,3-dihydro-1-benzothiepine
CAS Registry Number 66768-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12Cl2S
InChI InChI=1S/C16H12Cl2S/c17-13-10-15(18)19-14-9-5-4-8-12(14)16(13)11-6-2-1-3-7-11/h1-9,15H,10H2
InChIKey HVEKCSXWPGRZQT-UHFFFAOYSA-N
Molecular Weight 307.238 g/mol
SMILES C1(=C(c2c(cccc2)SC(C1)Cl)c1ccccc1)Cl
SPLASH splash10-000f-0090000000-ae0c7b3d02246f1040c0
Source of Spectrum J-43-3382-0
Wiley ID 1307897