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(3R*,4S*)-1-Benzoyl-3,4-epoxy-7-hydroxyhept-1-yne
SpectraBase Compound ID 7OJ2bxITEsK
InChI InChI=1S/C14H14O3/c15-10-4-7-13-14(17-13)9-8-12(16)11-5-2-1-3-6-11/h1-3,5-6,13-15H,4,7,10H2/t13-,14+/m0/s1
InChIKey FIWFISASFNKYPM-UONOGXRCSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uyj7xPdIwJ
Name (3R*,4S*)-1-Benzoyl-3,4-epoxy-7-hydroxyhept-1-yne
Alternate Name(s) 3-[(2R,3S)-3-(3-hydroxypropyl)oxiranyl]-1-phenyl-2-propyn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O3
InChI InChI=1S/C14H14O3/c15-10-4-7-13-14(17-13)9-8-12(16)11-5-2-1-3-6-11/h1-3,5-6,13-15H,4,7,10H2/t13-,14+/m0/s1
InChIKey FIWFISASFNKYPM-UONOGXRCSA-N
Molecular Weight 230.263 g/mol
SMILES OCCC[C@@]1(O[C@@]1(C#CC(=O)c1ccccc1)[H])[H]
SPLASH splash10-0229-9600000000-0bfecaa13cd66ab28092
Source of Spectrum F-54-836-3
Wiley ID 805512