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2H-Thiopyran-3-ol, tetrahydro-3-methyl-, acetate, 1-oxide, trans-
SpectraBase Compound ID 2ZOYrVrWbX9
InChI InChI=1S/C8H14O3S/c1-7(9)11-8(2)4-3-5-12(10)6-8/h3-6H2,1-2H3
InChIKey YJAOXFVBOUIJNM-UHFFFAOYSA-N
Mol Weight 190.26 g/mol
Molecular Formula C8H14O3S
Exact Mass 190.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BacqvhwMPdK
Name 2H-Thiopyran-3-ol, tetrahydro-3-methyl-, acetate, 1-oxide, trans-
Alternate Name(s) 2H-Thiopyran-3-ol, tetrahydro-3-methyl-, acetate, 1-oxide, cis- 3-Methyl-1-oxidotetrahydro-2H-thiopyran-3-yl acetate
CAS Registry Number 99797-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3S
InChI InChI=1S/C8H14O3S/c1-7(9)11-8(2)4-3-5-12(10)6-8/h3-6H2,1-2H3
InChIKey YJAOXFVBOUIJNM-UHFFFAOYSA-N
Molecular Weight 190.257 g/mol
SMILES C1S(CCCC1(OC(=O)C)C)=O
SPLASH splash10-001i-7900000000-f8eefa8a826d7a784617
Source of Spectrum J-51-686-20
Wiley ID 1186174