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(1R,2S,1'S)-2-(1'-Phenylmethanol)benzo-1,3-dithiole-1-oxide
SpectraBase Compound ID 99THyeZ2O7i
InChI InChI=1S/C14H12O2S2/c15-13(10-6-2-1-3-7-10)14-17-11-8-4-5-9-12(11)18(14)16/h1-9,13-15H/t13-,14-,18?/m0/s1
InChIKey WUGRKCRJMKKZMM-QPKCZYJBSA-N
Mol Weight 276.37 g/mol
Molecular Formula C14H12O2S2
Exact Mass 276.027872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImFaJDnmPmE
Name (1R,2S,1'S)-2-(1'-Phenylmethanol)benzo-1,3-dithiole-1-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O2S2
InChI InChI=1S/C14H12O2S2/c15-13(10-6-2-1-3-7-10)14-17-11-8-4-5-9-12(11)18(14)16/h1-9,13-15H/t13-,14-,18?/m0/s1
InChIKey WUGRKCRJMKKZMM-QPKCZYJBSA-N
Molecular Weight 276.368 g/mol
SMILES O[C@]([C@@]1(S(c2c(cccc2)S1)=O)[H])(c1ccccc1)[H]
SPLASH splash10-0udi-0940000000-9eaeef340470b0200d09
Source of Spectrum KC-60-557-9
Synonyms (1R,2R,1'R)-2-(1'-Phenylmethanol)benzo-1,3-dithiole-1-oxide (S)-[(2S)-1-oxo-1$l^{4},3-benzodithiol-2-yl]-phenylmethanol (S)-[(2S)-1-oxo-1$l^{4},3-benzodithiol-2-yl]-phenyl-methanol (S)-[(2S)-1-oxidanylidene-1$l^{4},3-benzodithiol-2-yl]-phenyl-methanol
Wiley ID 1583108