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4H-1-Benzothiopyran-4-one, 2-[(tetrahydro-2H-pyran-2-yl)thio]-
SpectraBase Compound ID DKH3JAjhRnK
InChI InChI=1S/C14H14O2S2/c15-11-9-14(18-13-7-3-4-8-16-13)17-12-6-2-1-5-10(11)12/h1-2,5-6,9,13H,3-4,7-8H2
InChIKey QIEXDZSMOHXWGW-UHFFFAOYSA-N
Mol Weight 278.38 g/mol
Molecular Formula C14H14O2S2
Exact Mass 278.043522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kcxgxTRAf7
Name 4H-1-Benzothiopyran-4-one, 2-[(tetrahydro-2H-pyran-2-yl)thio]-
CAS Registry Number 112519-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O2S2
InChI InChI=1S/C14H14O2S2/c15-11-9-14(18-13-7-3-4-8-16-13)17-12-6-2-1-5-10(11)12/h1-2,5-6,9,13H,3-4,7-8H2
InChIKey QIEXDZSMOHXWGW-UHFFFAOYSA-N
Molecular Weight 278.384 g/mol
SMILES C1(=CC(=O)c2c(S1)cccc2)SC1OCCCC1
SPLASH splash10-000i-8900000000-64fbc1f82c302c7718ac
Source of Spectrum B-40-1188-13
Synonyms 2-(tetrahydro-2H-pyran-2-ylsulfanyl)-4H-1-benzothiopyran-4-one 2-(tetrahydropyran-2'-yl)thio-1-thiochromone
Wiley ID 1281718