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

*Links on SpectraBase are not permalinks.
(+-)-11,12-cis-10,11-Dihydro-12-hydroxy-4-propyl-6,6,11-trimethyl-2H,6H,12H-benzo[1,2-b:3,4:b':5,6-b"]tripyran-2-one
SpectraBase Compound ID IE9141OR8wO
InChI InChI=1S/C21H24O5/c1-5-6-12-9-14(22)25-20-15(12)19-13(7-8-21(3,4)26-19)18-16(20)17(23)11(2)10-24-18/h7-9,11,17,23H,5-6,10H2,1-4H3/t11-,17-/m0/s1
InChIKey TXJUQTAMRSPFTG-GTNSWQLSSA-N
Mol Weight 356.42 g/mol
Molecular Formula C21H24O5
Exact Mass 356.162374 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 Kx2uhBeBQxK
Name (+-)-11,12-cis-10,11-Dihydro-12-hydroxy-4-propyl-6,6,11-trimethyl-2H,6H,12H-benzo[1,2-b:3,4:b':5,6-b"]tripyran-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O5
InChI InChI=1S/C21H24O5/c1-5-6-12-9-14(22)25-20-15(12)19-13(7-8-21(3,4)26-19)18-16(20)17(23)11(2)10-24-18/h7-9,11,17,23H,5-6,10H2,1-4H3/t11-,17-/m0/s1
InChIKey TXJUQTAMRSPFTG-GTNSWQLSSA-N
Molecular Weight 356.418 g/mol
SMILES O[C@@]1(c2c(c3C=CC(Oc3c3c2OC(C=C3CCC)=O)(C)C)OC[C@@]1(C)[H])[H]
SPLASH splash10-0006-0009000000-5bd21f6be73919a576cd
Source of Spectrum E1-40-1014-21
Wiley ID 1599197