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Methyl (3S,5R,6E)-7-Phenyl-3,5-dihydroxy-6-heptenoate
SpectraBase Compound ID EcIol0CuSje
InChI InChI=1S/C14H18O4/c1-18-14(17)10-13(16)9-12(15)8-7-11-5-3-2-4-6-11/h2-8,12-13,15-16H,9-10H2,1H3/b8-7+/t12-,13-/m0/s1
InChIKey VCNWJEZPTFGKLI-FVWNJDPFSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFy8AarHqPb
Name Methyl (3S,5R,6E)-7-Phenyl-3,5-dihydroxy-6-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-18-14(17)10-13(16)9-12(15)8-7-11-5-3-2-4-6-11/h2-8,12-13,15-16H,9-10H2,1H3/b8-7+/t12-,13-/m0/s1
InChIKey VCNWJEZPTFGKLI-FVWNJDPFSA-N
Molecular Weight 250.294 g/mol
SMILES O[C@](C[C@@](CC(=O)OC)(O)[H])(\C=C\c1ccccc1)[H]
SPLASH splash10-0zfr-0910000000-f4d8ba348dd39a21054a
Source of Spectrum AJ-68-367-7
Synonyms Methyl (3S,5R,6E)-3,5-dihydroxy-7-phenyl-6-heptenoate
Wiley ID 773000