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

*Links on SpectraBase are not permalinks.
8-Chloro-5-hydro-2,7-dimethyl-2-[(E)-4-(tetrahydro-5,5-dimethyl-4-oxofuran-2-yl)pent-3-enyl]-2H-1-benzopyran-6-carbaldehyde
SpectraBase Compound ID Dt7e4tJXC4M
InChI InChI=1S/C23H27ClO5/c1-13(17-11-18(26)22(3,4)28-17)7-6-9-23(5)10-8-15-20(27)16(12-25)14(2)19(24)21(15)29-23/h7-8,10,12,17,27H,6,9,11H2,1-5H3/b13-7+
InChIKey ZSGRUNQIBGNHBU-NTUHNPAUSA-N
Mol Weight 418.92 g/mol
Molecular Formula C23H27ClO5
Exact Mass 418.154702 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 8qeHMXMXA8h
Name 8-Chloro-5-hydro-2,7-dimethyl-2-[(E)-4-(tetrahydro-5,5-dimethyl-4-oxofuran-2-yl)pent-3-enyl]-2H-1-benzopyran-6-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27ClO5
InChI InChI=1S/C23H27ClO5/c1-13(17-11-18(26)22(3,4)28-17)7-6-9-23(5)10-8-15-20(27)16(12-25)14(2)19(24)21(15)29-23/h7-8,10,12,17,27H,6,9,11H2,1-5H3/b13-7+
InChIKey ZSGRUNQIBGNHBU-NTUHNPAUSA-N
Molecular Weight 418.917 g/mol
SMILES Oc1c2c(c(c(c1C=O)C)Cl)OC(C=C2)(CC\C=C\(C1OC(C)(C)C(C1)=O)C)C
SPLASH splash10-000j-5490000000-973eea94e57c6e3bab95
Source of Spectrum AJ-68-2733-31
Synonyms 8-Chloro-2-[(3E)-4-(5,5-dimethyl-4-oxotetrahydro-2-furanyl)-3-pentenyl]-5-hydroxy-2,7-dimethyl-2H-chromene-6-carbaldehyde
Wiley ID 773348