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(E,5R)-5-hydroxy-3-hexenoic acid methyl ester
SpectraBase Compound ID GT1xcVnqnt2
InChI InChI=1S/C7H12O3/c1-6(8)4-3-5-7(9)10-2/h3-4,6,8H,5H2,1-2H3/b4-3+/t6-/m1/s1
InChIKey XOBUITCCYSUOEP-FCJGRKLLSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3D4nSJ1D4S1
Name (E,5R)-5-hydroxy-3-hexenoic acid methyl ester
Alternate Name(s) (E,5R)-5-hydroxyhex-3-enoic acid methyl ester Methyl (E,5R)-5-hydroxyhex-3-enoate Methyl (E,5R)-5-oxidanylhex-3-enoate
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Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-6(8)4-3-5-7(9)10-2/h3-4,6,8H,5H2,1-2H3/b4-3+/t6-/m1/s1
InChIKey XOBUITCCYSUOEP-FCJGRKLLSA-N
Molecular Weight 144.170 g/mol
SMILES O[C@@](\C=C\CC(=O)OC)(C)[H]
SPLASH splash10-004i-3900000000-86ecffcfd5e106491b3c
Source of Spectrum J-58-1529-14
Wiley ID 1142491