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3-Carboethoxy-3,4-dihydro-2H-thiopyran

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Carboethoxy-3,4-dihydro-2H-thiopyran
SpectraBase Compound ID 9mHJDuzGbdg
InChI InChI=1S/C8H12O2S/c1-2-10-8(9)7-4-3-5-11-6-7/h3,5,7H,2,4,6H2,1H3
InChIKey UALNDXRGMLLSFL-UHFFFAOYSA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hn24FCfGc1g
Name 2H-Thiopyran-3-carboxylic acid, 3,4-dihydro-, ethyl ester
Alternate Name(s) 3-Carboethoxy-3,4-dihydro-2H-thiopyran Ethyl 3,4-dihydro-2H-thiopyran-3-carboxylate
CAS Registry Number 116664-51-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c1-2-10-8(9)7-4-3-5-11-6-7/h3,5,7H,2,4,6H2,1H3
InChIKey UALNDXRGMLLSFL-UHFFFAOYSA-N
Molecular Weight 172.242 g/mol
SMILES C(C1CSC=CC1)(=O)OCC
SPLASH splash10-0002-9200000000-4a221c744a18b16c22be
Source of Spectrum C-110-7826-40
Wiley ID 1168393