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(S)-7-Phenyl-5-hydroxyheptyl Pivalate
SpectraBase Compound ID 8GK9Jf1KhsS
InChI InChI=1S/C18H28O3/c1-18(2,3)17(20)21-14-8-7-11-16(19)13-12-15-9-5-4-6-10-15/h4-6,9-10,16,19H,7-8,11-14H2,1-3H3/t16-/m0/s1
InChIKey VHIPRMCCCZFNBE-INIZCTEOSA-N
Mol Weight 292.42 g/mol
Molecular Formula C18H28O3
Exact Mass 292.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID t6iIIzc3cW
Name (S)-7-Phenyl-5-hydroxyheptyl Pivalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O3
InChI InChI=1S/C18H28O3/c1-18(2,3)17(20)21-14-8-7-11-16(19)13-12-15-9-5-4-6-10-15/h4-6,9-10,16,19H,7-8,11-14H2,1-3H3/t16-/m0/s1
InChIKey VHIPRMCCCZFNBE-INIZCTEOSA-N
Molecular Weight 292.419 g/mol
SMILES O[C@](CCc1ccccc1)(CCCCOC(C(C)(C)C)=O)[H]
SPLASH splash10-0a4i-9200000000-92ee668311ff178e4fa9
Source of Spectrum J-62-7897-6
Synonyms (5S)-5-hydroxy-7-phenylheptyl pivalate 2,2-Dimethylpropanoic acid [(5S)-5-hydroxy-7-phenylheptyl] ester [(5S)-5-hydroxy-7-phenylheptyl] 2,2-dimethylpropanoate [(5S)-5-hydroxy-7-phenyl-heptyl] 2,2-dimethylpropanoate [(5S)-5-oxidanyl-7-phenyl-heptyl] 2,2-dimethylpropanoate
Wiley ID 1295757