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1-Cyclohexylbenzo[d][1,3,2]dithiazole 1-oxide
SpectraBase Compound ID 1sTiSYQEwDq
InChI InChI=1S/C12H15NOS2/c14-16(10-6-2-1-3-7-10)12-9-5-4-8-11(12)15-13-16/h4-5,8-10H,1-3,6-7H2
InChIKey NUZZZNWKVJBLFF-UHFFFAOYSA-N
Mol Weight 253.38 g/mol
Molecular Formula C12H15NOS2
Exact Mass 253.059506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eybm0vhK4ZG
Name 1-Cyclohexylbenzo[d][1,3,2]dithiazole 1-oxide
Appearance Yellow oil
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Formula C12H15NOS2
InChI InChI=1S/C12H15NOS2/c14-16(10-6-2-1-3-7-10)12-9-5-4-8-11(12)15-13-16/h4-5,8-10H,1-3,6-7H2
InChIKey NUZZZNWKVJBLFF-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202201408
Molecular Weight 253.378 g/mol
Quality 148
Reported Formula C12H15ONS2
SMILES C1(S2(=NSC3=C2C=CC=C3)=O)CCCCC1
SPLASH splash10-0udi-4910000000-ed35b8cd8b206733881d
Source of Spectrum ASC-365-SM22-2y (DOI: 10.1002/adsc.202201408)
Wiley ID 1902707