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(1RS,2SR,3RS)-1-Ethyl-3-hydroxy-2-methylpentyl propanoate
SpectraBase Compound ID 4sBshH8dgZt
InChI InChI=1S/C11H22O3/c1-5-9(12)8(4)10(6-2)14-11(13)7-3/h8-10,12H,5-7H2,1-4H3/t8-,9+,10+/m0/s1
InChIKey ZWLYEVPWPYSAKA-IVZWLZJFSA-N
Mol Weight 202.29 g/mol
Molecular Formula C11H22O3
Exact Mass 202.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJFuGbzTFo3
Name (1RS,2SR,3RS)-1-Ethyl-3-hydroxy-2-methylpentyl propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O3
InChI InChI=1S/C11H22O3/c1-5-9(12)8(4)10(6-2)14-11(13)7-3/h8-10,12H,5-7H2,1-4H3/t8-,9+,10+/m0/s1
InChIKey ZWLYEVPWPYSAKA-IVZWLZJFSA-N
Molecular Weight 202.294 g/mol
SMILES O[C@@]([C@@]([C@](OC(=O)CC)(CC)[H])(C)[H])(CC)[H]
SPLASH splash10-00fr-4900000000-1835d5cb7f571d7ea820
Source of Spectrum SO-0-253-3
Synonyms (1RS,2RS,3RS)-1-Ethyl-3-hydroxy-2-methylpentyl propanoate 1-Ethyl-3-hydroxy-2-methylpentyl propionate 5-Hydroxy-4-methylhept-3-yl propanoate Propanoic acid [(3R,4S,5R)-5-hydroxy-4-methylheptan-3-yl] ester [(3R,4S,5R)-5-hydroxy-4-methylheptan-3-yl] propanoate [(1R,2S,3R)-1-ethyl-3-hydroxy-2-methyl-pentyl] propanoate [(3R,4S,5R)-4-methyl-5-oxidanyl-heptan-3-yl] propanoate
Wiley ID 877244