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2-(4-nitrophenyl)-6,7-dihydro-5H-1,4-dithiepin
SpectraBase Compound ID L8Qy860RE8A
InChI InChI=1S/C11H11NO2S2/c13-12(14)10-4-2-9(3-5-10)11-8-15-6-1-7-16-11/h2-5,8H,1,6-7H2
InChIKey JGTKUBBBKPTXEE-UHFFFAOYSA-N
Mol Weight 253.33 g/mol
Molecular Formula C11H11NO2S2
Exact Mass 253.023121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjTPHtpext3
Name 2-(4-nitrophenyl)-6,7-dihydro-5H-1,4-dithiepin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S2
InChI InChI=1S/C11H11NO2S2/c13-12(14)10-4-2-9(3-5-10)11-8-15-6-1-7-16-11/h2-5,8H,1,6-7H2
InChIKey JGTKUBBBKPTXEE-UHFFFAOYSA-N
Molecular Weight 253.334 g/mol
SMILES c1(N(=O)=O)ccc(C=2SCCCSC2)cc1
SPLASH splash10-0udi-3690000000-15625b8a22068971f1b3
Source of Spectrum HE-1999-414-4
Synonyms 2-(4-nitrophenyl)-6,7-dihydro-5H-1,4-dithiepine
Wiley ID 1613467