For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ethyl 6(S)-(benzoyloxy)-7-hydroxyheptanoate
SpectraBase Compound ID 1O2B9isUE0S
InChI InChI=1S/C16H22O5/c1-2-20-15(18)11-7-6-10-14(12-17)21-16(19)13-8-4-3-5-9-13/h3-5,8-9,14,17H,2,6-7,10-12H2,1H3/t14-/m0/s1
InChIKey PCIVTWUAJKQWFL-AWEZNQCLSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2sFMlhuhtYe
Name Ethyl 6(S)-(benzoyloxy)-7-hydroxyheptanoate
Alternate Name(s) (1S)-6-ethoxy-1-(hydroxymethyl)-6-oxohexyl benzoate
CAS Registry Number 119392-35-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-2-20-15(18)11-7-6-10-14(12-17)21-16(19)13-8-4-3-5-9-13/h3-5,8-9,14,17H,2,6-7,10-12H2,1H3/t14-/m0/s1
InChIKey PCIVTWUAJKQWFL-AWEZNQCLSA-N
Molecular Weight 294.347 g/mol
SMILES OC[C@@](OC(=O)c1ccccc1)(CCCCC(=O)OCC)[H]
SPLASH splash10-0a4i-1940000000-058d241a424dcb52933a
Source of Spectrum J-54-2414-18
Wiley ID 1297140