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XCJJYQRFPYKZAU-UHFFFAOYSA-N
SpectraBase Compound ID A4sRbr9M8de
InChI InChI=1S/C10H10OS/c1-7-6-12-9-5-3-2-4-8(9)10(7)11/h2-5,7H,6H2,1H3
InChIKey XCJJYQRFPYKZAU-UHFFFAOYSA-N
Mol Weight 178.25 g/mol
Molecular Formula C10H10OS
Exact Mass 178.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsKCfktdFTp
Name 4H-1-Benzothiopyran-4-one, 2,3-dihydro-3-methyl-
Alternate Name(s) Thiochroman-4-one, 3-methyl- 3-Methyl-2,3-dihydro-4H-thiochromen-4-one 3-Methyl-2,3-dihydro-1-benzothiopyran-4-one 3-Methyl-2,3-dihydrothiochromen-4-one 3-Methylthiochroman-4-one
CAS Registry Number 771-17-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10OS
InChI InChI=1S/C10H10OS/c1-7-6-12-9-5-3-2-4-8(9)10(7)11/h2-5,7H,6H2,1H3
InChIKey XCJJYQRFPYKZAU-UHFFFAOYSA-N
Molecular Weight 178.249 g/mol
SMILES CC1CSc2ccccc2C1=O
SPLASH splash10-000i-2900000000-bb2c6cd9dc4500467944
Source of Spectrum O-3-901-1
Wiley ID 1173890