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

*Links on SpectraBase are not permalinks.
[4-Hydroxymethyl-2-hexyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
SpectraBase Compound ID KakKmYKsY1R
InChI InChI=1S/C24H34O4/c1-3-4-5-9-12-20-21(17-10-7-6-8-11-17)22-18(14-25)13-19(15-28-16(2)26)23(22)24(20)27/h6-8,10-11,18-23,25H,3-5,9,12-15H2,1-2H3
InChIKey QSMDBEFIZPGCPI-UHFFFAOYSA-N
Mol Weight 386.5 g/mol
Molecular Formula C24H34O4
Exact Mass 386.24571 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 3K53LN65nk
Name [4-Hydroxymethyl-2-hexyl-3-phenyl-1-oxooctahydropentalen-6-yl]methyl acetate
Alternate Name(s) [5-hexyl-3-(hydroxymethyl)-6-oxo-4-phenyloctahydro-1-pentalenyl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O4
InChI InChI=1S/C24H34O4/c1-3-4-5-9-12-20-21(17-10-7-6-8-11-17)22-18(14-25)13-19(15-28-16(2)26)23(22)24(20)27/h6-8,10-11,18-23,25H,3-5,9,12-15H2,1-2H3
InChIKey QSMDBEFIZPGCPI-UHFFFAOYSA-N
Molecular Weight 386.532 g/mol
SMILES OCC1C2C(C(C(C2C(COC(C)=O)C1)=O)CCCCCC)c1ccccc1
SPLASH splash10-0fr6-6943000000-45b3588421ce51f06c0d
Source of Spectrum K1-0-2224-4
Wiley ID 1588852