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2-Thiaadamantan-4-one
SpectraBase Compound ID KdjABRBsggy
InChI InChI=1S/C9H12OS/c10-9-6-1-5-2-7(4-6)11-8(9)3-5/h5-8H,1-4H2/t5-,6+,7-,8+/m1/s1
InChIKey PHRHIGFHKPECKC-CWKFCGSDSA-N
Mol Weight 168.25 g/mol
Molecular Formula C9H12OS
Exact Mass 168.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHikq1XZsWN
Name 2-THIAADAMANTAN-4-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12OS
InChI InChI=1S/C9H12OS/c10-9-6-1-5-2-7(4-6)11-8(9)3-5/h5-8H,1-4H2/t5-,6+,7-,8+/m1/s1
InChIKey PHRHIGFHKPECKC-CWKFCGSDSA-N
Molecular Weight 168.0606
SMILES [C@]12(C[C@@]3(C[C@@](C(=O)[C@@](C3)(C1)[H])(S2)[H])[H])[H]
SPLASH splash10-00ke-9300000000-8741e9634e728698138e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany