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2-[1'-13C]Phenyl[2-13C]-1,3-dithiane

View entire compound with spectra: 1 MS (GC)

2-[1'-13C]Phenyl[2-13C]-1,3-dithiane
SpectraBase Compound ID BWgF89osoox
InChI InChI=1S/C10H12S2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2/i9+1,10+1
InChIKey GXKPARDRBFURON-OJJJIBSVSA-N
Mol Weight 198.31 g/mol
Molecular Formula C813C2H12S2
Exact Mass 198.044752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JKnRZvkwb8
Name 2-[1'-13C]Phenyl[2-13C]-1,3-dithiane
Comments Original formula: C8[13C]2H12S2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12S2
InChI InChI=1S/C10H12S2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2/i9+1,10+1
InChIKey GXKPARDRBFURON-OJJJIBSVSA-N
Molecular Weight 198.311 g/mol
SMILES [13CH]1([13c]2ccccc2)SCCCS1
SPLASH splash10-00dj-2900000000-3199487bfcb2dc165ea3
Source of Spectrum H-67-1080-0
Wiley ID 1192900