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(E)-syn-Methyl 3-hydroxy-2-methyl-3-phenyl-4-pentenoate
SpectraBase Compound ID 13uG5Z7WKxu
InChI InChI=1S/C13H16O3/c1-10(13(15)16-2)12(14)9-8-11-6-4-3-5-7-11/h3-10,12,14H,1-2H3/b9-8+/t10-,12+/m1/s1
InChIKey BUZBSPGKKVOQOO-QMTFQVMMSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rQmLHbFv3t
Name (E)-syn-Methyl 3-hydroxy-2-methyl-3-phenyl-4-pentenoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-10(13(15)16-2)12(14)9-8-11-6-4-3-5-7-11/h3-10,12,14H,1-2H3/b9-8+/t10-,12+/m1/s1
InChIKey BUZBSPGKKVOQOO-QMTFQVMMSA-N
Molecular Weight 220.268 g/mol
SMILES O[C@@](\C=C\c1ccccc1)([C@](C(=O)OC)(C)[H])[H]
SPLASH splash10-001i-0900000000-9af41d33d493b361e901
Source of Spectrum C-116-7041-24
Synonyms (E)-syn-Methyl 3-hydroxy-2-methyl-5-phenyl-4-pentenoate methyl 3-hydroxy-2-methyl-3-phenyl-4-pentenoate (E,2R,3S)-3-hydroxy-2-methyl-5-phenyl-4-pentenoic acid methyl ester methyl (E,2R,3S)-3-hydroxy-2-methyl-5-phenylpent-4-enoate methyl (E,2R,3S)-3-hydroxy-2-methyl-5-phenyl-pent-4-enoate methyl (E,2R,3S)-2-methyl-3-oxidanyl-5-phenyl-pent-4-enoate
Wiley ID 1219951