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(2S,3R)-2,3-Epoxy-7-hydroxyheptyl 4-phenylbenzoate
SpectraBase Compound ID IXmjfMKWVJB
InChI InChI=1S/C20H22O4/c21-13-5-4-8-18-19(24-18)14-23-20(22)17-11-9-16(10-12-17)15-6-2-1-3-7-15/h1-3,6-7,9-12,18-19,21H,4-5,8,13-14H2/t18-,19+/m1/s1
InChIKey NSRYRASOBIJLTO-MOPGFXCFSA-N
Mol Weight 326.39 g/mol
Molecular Formula C20H22O4
Exact Mass 326.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EuZykliiLeH
Name (2S,3R)-2,3-Epoxy-7-hydroxyheptyl 4-phenylbenzoate
Alternate Name(s) [(2S,3R)-3-(4-hydroxybutyl)oxiranyl]methyl[1,1'-biphenyl]-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O4
InChI InChI=1S/C20H22O4/c21-13-5-4-8-18-19(24-18)14-23-20(22)17-11-9-16(10-12-17)15-6-2-1-3-7-15/h1-3,6-7,9-12,18-19,21H,4-5,8,13-14H2/t18-,19+/m1/s1
InChIKey NSRYRASOBIJLTO-MOPGFXCFSA-N
Molecular Weight 326.392 g/mol
SMILES OCCCC[C@]1(O[C@]1(COC(c1ccc(cc1)-c1ccccc1)=O)[H])[H]
SPLASH splash10-0ue9-0900000000-f161125eef92269fc703
Source of Spectrum H1-47-420-4
Wiley ID 816096