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

*Links on SpectraBase are not permalinks.
O-ACETYL-1-HYDROXY-2-METHOXY-1,2,3,4-DEHYDROCACALONE
SpectraBase Compound ID 5nfYo1s0Nb5
InChI InChI=1S/C18H18O6/c1-8-6-11(22-5)15(20)12-13(8)18(4,24-10(3)19)14-9(2)7-23-17(14)16(12)21/h6-7,20H,1-5H3
InChIKey PNTHREYKXSVFOA-UHFFFAOYSA-N
Mol Weight 330.34 g/mol
Molecular Formula C18H18O6
Exact Mass 330.110338 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 Gskgc5qyRaq
Name 1-Hydroxy-O-acetyl-2-methoxy-1,2,3,4-dehydro-cacalone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O6
InChI InChI=1S/C18H18O6/c1-8-6-11(22-5)15(20)12-13(8)18(4,24-10(3)19)14-9(2)7-23-17(14)16(12)21/h6-7,20H,1-5H3
InChIKey PNTHREYKXSVFOA-UHFFFAOYSA-N
Molecular Weight 330.336 g/mol
SMILES Oc1c2C(c3c(C(OC(=O)C)(C)c2c(cc1OC)C)c(C)co3)=O
SPLASH splash10-00di-0190000000-0613842f348ccddcb21e
Source of Spectrum G4-64-521-12
Synonyms Acetic acid (8-hydroxy-7-methoxy-3,4,5-trimethyl-9-oxo-4-benzo[f]benzofuranyl) ester (8-hydroxy-7-methoxy-3,4,5-trimethyl-9-oxobenzo[f][1]benzofuran-4-yl) acetate (8-hydroxy-7-methoxy-3,4,5-trimethyl-9-oxo-benzo[f]benzofuran-4-yl) acetate (7-methoxy-3,4,5-trimethyl-8-oxidanyl-9-oxidanylidene-benzo[f][1]benzofuran-4-yl) ethanoate
Wiley ID 1608921