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Spiro[1,3-benzodithiole-2,6'-bicyclo[3.2.1]octan]-4'-one
SpectraBase Compound ID LgpWkeDsuY2
InChI InChI=1S/C14H14OS2/c15-11-6-5-9-7-10(11)14(8-9)16-12-3-1-2-4-13(12)17-14/h1-4,9-10H,5-8H2/t9-,10-/m0/s1
InChIKey VXKDJUWONSVEDS-UWVGGRQHSA-N
Mol Weight 262.38 g/mol
Molecular Formula C14H14OS2
Exact Mass 262.048607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A03ybKPdMey
Name Spiro[1,3-benzodithiole-2,6'-bicyclo[3.2.1]octan]-4'-one
CAS Registry Number 115436-07-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14OS2
InChI InChI=1S/C14H14OS2/c15-11-6-5-9-7-10(11)14(8-9)16-12-3-1-2-4-13(12)17-14/h1-4,9-10H,5-8H2/t9-,10-/m0/s1
InChIKey VXKDJUWONSVEDS-UWVGGRQHSA-N
Molecular Weight 262.385 g/mol
SMILES C12([C@@]3(C(=O)CC[C@](C2)(C3)[H])[H])Sc2ccccc2S1
SPLASH splash10-0bvi-0890000000-2f49317014d276ecfdea
Source of Spectrum J-55-5086-23
Synonyms 7,7-(1,2-Benzenediyldithio)bicyclo[3.2.1]ictan-2-one Spiro[1,3-benzodithiole-2,6'-bicyclo[3.2.1]octane]-4'-one
Wiley ID 1265646