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7-Methyl-1,2,3,4,5-benzopentathiepin

View entire compound with spectra: 1 MS (GC)

7-Methyl-1,2,3,4,5-benzopentathiepin
SpectraBase Compound ID KHFCfiO7Oai
InChI InChI=1S/C7H6S5/c1-5-2-3-6-7(4-5)9-11-12-10-8-6/h2-4H,1H3
InChIKey UCLBADMPOHUZHA-UHFFFAOYSA-N
Mol Weight 250.4 g/mol
Molecular Formula C7H6S5
Exact Mass 249.907306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLSGG7oHjMH
Name 7-Methyl-1,2,3,4,5-benzopentathiepin
Alternate Name(s) 7-Methyl-1,2,3,4,5-benzopentathiepine 7-Methylbenzopentathiepin
CAS Registry Number 109988-33-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6S5
InChI InChI=1S/C7H6S5/c1-5-2-3-6-7(4-5)9-11-12-10-8-6/h2-4H,1H3
InChIKey UCLBADMPOHUZHA-UHFFFAOYSA-N
Molecular Weight 250.425 g/mol
SMILES Cc1ccc2c(c1)SSSSS2
SPLASH splash10-000i-0910000000-99c039eb9131c9e7d733
Source of Spectrum KC-1987-215-18
Wiley ID 1252560