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2,3,10,10a-tetrahydro-4a-hydroxy-1H-thioxanthen-4(4aH)-one
SpectraBase Compound ID AUrcvqSC6XZ
InChI InChI=1S/C13H14O2S/c14-12-7-3-5-10-8-9-4-1-2-6-11(9)16-13(10,12)15/h1-2,4,8,11,15H,3,5-7H2
InChIKey PFQKVHVEMJVNTK-UHFFFAOYSA-N
Mol Weight 234.31 g/mol
Molecular Formula C13H14O2S
Exact Mass 234.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLnwq8i73eX
Name 2,3,10,10a-tetrahydro-4a-hydroxy-1H-thioxanthen-4(4aH)-one
CAS Registry Number 124921-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2S
InChI InChI=1S/C13H14O2S/c14-12-7-3-5-10-8-9-4-1-2-6-11(9)16-13(10,12)15/h1-2,4,8,11,15H,3,5-7H2
InChIKey PFQKVHVEMJVNTK-UHFFFAOYSA-N
Molecular Weight 234.313 g/mol
SMILES OC12SC3CC=CC=C3C=C2CCCC1=O
SPLASH splash10-03la-0910000000-6cf45035962911c0085c
Source of Spectrum K-123-1148-6
Synonyms 4a-hydroxy-2,3,5a,6-tetrahydro-1H-dibenzo[b,e]thiopyran-4(4aH)-one
Wiley ID 1235845