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

*Links on SpectraBase are not permalinks.
2-Acetoxyethyl-2,8-dimethyl-6-hexyl-8-(2-hydroxyethyl)-3,4,9,10-tetrahydro-2h,8h-benzo(1,2-b:3,4-b')dipyran
SpectraBase Compound ID Jd6820JMTHO
InChI InChI=1S/C26H40O5/c1-5-6-7-8-9-20-18-21-10-12-26(4,15-17-29-19(2)28)31-24(21)22-11-13-25(3,14-16-27)30-23(20)22/h18,27H,5-17H2,1-4H3
InChIKey IYYCMEMGCSSERE-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C26H40O5
Exact Mass 432.287574 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 3qreOMk7ei8
Name 2-Acetoxyethyl-2,8-dimethyl-6-hexyl-8-(2-hydroxyethyl)-3,4,9,10-tetrahydro-2h,8h-benzo(1,2-b:3,4-b')dipyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O5
InChI InChI=1S/C26H40O5/c1-5-6-7-8-9-20-18-21-10-12-26(4,15-17-29-19(2)28)31-24(21)22-11-13-25(3,14-16-27)30-23(20)22/h18,27H,5-17H2,1-4H3
InChIKey IYYCMEMGCSSERE-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 432.601 g/mol
SMILES OCCC1(Oc2c(c3OC(CCc3cc2CCCCCC)(C)CCOC(C)=O)CC1)C
SPLASH splash10-0006-5497100000-6b89773e20224c750890
Source of Spectrum SRH-2022-10090-0
Wiley ID 1831716