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(2R*,3R*)-2-Allyl-3-hydroxyoctanoic acid methyl ester
SpectraBase Compound ID HA9rDXr6e64
InChI InChI=1S/C12H22O3/c1-4-6-7-9-11(13)10(8-5-2)12(14)15-3/h5,10-11,13H,2,4,6-9H2,1,3H3/t10-,11-/m1/s1
InChIKey QPPZQBWYICKTLI-GHMZBOCLSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HIyRQDcEj9U
Name (2R*,3R*)-2-Allyl-3-hydroxyoctanoic acid methyl ester
Alternate Name(s) Methyl (2R)-2-[(1R)-1-hydroxyhexyl]-4-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-4-6-7-9-11(13)10(8-5-2)12(14)15-3/h5,10-11,13H,2,4,6-9H2,1,3H3/t10-,11-/m1/s1
InChIKey QPPZQBWYICKTLI-GHMZBOCLSA-N
Molecular Weight 214.305 g/mol
SMILES O[C@@]([C@](C(=O)OC)(CC=C)[H])(CCCCC)[H]
SPLASH splash10-054o-9400000000-790b7af30264373436a7
Source of Spectrum KC-61-2717-12
Wiley ID 1628206