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5-Hexenoic acid, 4-methoxy-2-methyl-, methyl ester, [S-(R*,R*)]-
SpectraBase Compound ID I2y3biHgmWQ
InChI InChI=1S/C9H16O3/c1-5-8(11-3)6-7(2)9(10)12-4/h5,7-8H,1,6H2,2-4H3/t7-,8+/m0/s1
InChIKey MGFQZIYBKPMMPL-JGVFFNPUSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96rd0dCS8iM
Name 5-Hexenoic acid, 4-methoxy-2-methyl-, methyl ester, [S-(R*,R*)]-
CAS Registry Number 93286-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-5-8(11-3)6-7(2)9(10)12-4/h5,7-8H,1,6H2,2-4H3/t7-,8+/m0/s1
InChIKey MGFQZIYBKPMMPL-JGVFFNPUSA-N
Molecular Weight 172.224 g/mol
SMILES C([C@](C[C@@](C=C)(OC)[H])(C)[H])(=O)OC
SPLASH splash10-00di-9000000000-46dfefe778a1a7efc816
Source of Spectrum H-67-1346-0
Synonyms Methyl (2S,4S)-4-methoxy-2-methyl-5-hexenoate Methyl-(2S,4S)-4-methoxy-2-methylhex-5-enoate
Wiley ID 1168673