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1-Cyclohexene-1-carboxylic acid, 4-hydroxy-3-(phenylseleno)-, methyl ester, trans-(.+-.)-
SpectraBase Compound ID 7UEYvUOpj7E
InChI InChI=1S/C14H16O3Se/c1-17-14(16)10-7-8-12(15)13(9-10)18-11-5-3-2-4-6-11/h2-6,9,12-13,15H,7-8H2,1H3/t12-,13-/m0/s1
InChIKey OLAHNINKGTZSER-STQMWFEESA-N
Mol Weight 311.25 g/mol
Molecular Formula C14H16O3Se
Exact Mass 312.026466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9H9Im5iO1qB
Name 1-Cyclohexene-1-carboxylic acid, 4-hydroxy-3-(phenylseleno)-, methyl ester, trans-(.+-.)-
Alternate Name(s) Methyl (3S,4S)-4-hydroxy-3-(phenylselanyl)-1-cyclohexene-1-carboxylate Methyl 3.beta.-(phenylseleno)-4.alpha.-hydroxycyclohex-1-ene-1-carboxylate
CAS Registry Number 115162-78-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O3Se
InChI InChI=1S/C14H16O3Se/c1-17-14(16)10-7-8-12(15)13(9-10)18-11-5-3-2-4-6-11/h2-6,9,12-13,15H,7-8H2,1H3/t12-,13-/m0/s1
InChIKey OLAHNINKGTZSER-STQMWFEESA-N
Molecular Weight 311.251 g/mol
SMILES O[C@]1(CCC(=C[C@@]1([Se]c1ccccc1)[H])C(=O)OC)[H]
SPLASH splash10-006t-9801000000-bbf296b7f32078cdffeb
Source of Spectrum J-53-3264-9
Wiley ID 1312933