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

*Links on SpectraBase are not permalinks.
1(2H)-Naphthalenone, 4-ethoxy-5-hydroxy-2-(5-hydroxy-4-methoxy-7-methyl-1-oxo-2(1H)-naphthalenylidene)-7-methyl-, (E)-
SpectraBase Compound ID BeRFkRPrNYK
InChI InChI=1S/C25H22O6/c1-5-31-21-11-15(25(29)17-7-13(3)9-19(27)23(17)21)14-10-20(30-4)22-16(24(14)28)6-12(2)8-18(22)26/h6-11,26-27H,5H2,1-4H3/b15-14+
InChIKey SBTFMDPVZCIUNK-CCEZHUSRSA-N
Mol Weight 418.45 g/mol
Molecular Formula C25H22O6
Exact Mass 418.141638 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 AenTATWWT36
Name 1(2H)-Naphthalenone, 4-ethoxy-5-hydroxy-2-(5-hydroxy-4-methoxy-7-methyl-1-oxo-2(1H)-naphthalenylidene)-7-methyl-, (E)-
CAS Registry Number 103412-18-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22O6
InChI InChI=1S/C25H22O6/c1-5-31-21-11-15(25(29)17-7-13(3)9-19(27)23(17)21)14-10-20(30-4)22-16(24(14)28)6-12(2)8-18(22)26/h6-11,26-27H,5H2,1-4H3/b15-14+
InChIKey SBTFMDPVZCIUNK-CCEZHUSRSA-N
Molecular Weight 418.445 g/mol
SMILES Oc1cc(cc2C(\C(=C/3C=C(c4c(cc(cc4C3=O)C)O)OCC)C=C(c12)OC)=O)C
SPLASH splash10-00kr-0008900000-92434745d3eb276aa4fb
Source of Spectrum KC-1986-680-17
Synonyms 4-Ethoxy-5,5'-dihydroxy-4'-methoxy-7,7'-dimethyl-2,2'-binaphthyl-1,1'-quinone 4-Ethoxy-5-hydroxy-2-[(2E)-5-hydroxy-4-methoxy-7-methyl-1-oxo-1,2-dihydronaphthalen-2-ylidene]-7-methyl-1,2-dihydronaphthalen-1-one
Wiley ID 1377293