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1,3-Dithiane, 2-methyl-2-(4-nitrophenyl)-
SpectraBase Compound ID J17itxT0ikj
InChI InChI=1S/C11H13NO2S2/c1-11(15-7-2-8-16-11)9-3-5-10(6-4-9)12(13)14/h3-6H,2,7-8H2,1H3
InChIKey HAAQEZNFDPEUHI-UHFFFAOYSA-N
Mol Weight 255.35 g/mol
Molecular Formula C11H13NO2S2
Exact Mass 255.038771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 644wZRwefF2
Name 1,3-Dithiane, 2-methyl-2-(4-nitrophenyl)-
CAS Registry Number 67395-06-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO2S2
InChI InChI=1S/C11H13NO2S2/c1-11(15-7-2-8-16-11)9-3-5-10(6-4-9)12(13)14/h3-6H,2,7-8H2,1H3
InChIKey HAAQEZNFDPEUHI-UHFFFAOYSA-N
Molecular Weight 255.350 g/mol
SMILES c1(N(=O)=O)ccc(C2(SCCCS2)C)cc1
SPLASH splash10-0ab9-4980000000-c53642a4ae23b00f0002
Source of Spectrum O-21-336-3
Synonyms 2-Methyl-2-(4-nitrophenyl)-1,3-dithiane
Wiley ID 1258619