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2-(3,5-dimethoxybenzyl)-2-(3,5-dimethylbenzyl)2,3-dihydro-5,7-dimethoxy-1H-indene-1-one
SpectraBase Compound ID AJmXkupad76
InChI InChI=1S/C29H32O5/c1-18-7-19(2)9-20(8-18)15-29(16-21-10-23(31-3)13-24(11-21)32-4)17-22-12-25(33-5)14-26(34-6)27(22)28(29)30/h7-14H,15-17H2,1-6H3
InChIKey QKKNBIFXRIEVKE-UHFFFAOYSA-N
Mol Weight 460.6 g/mol
Molecular Formula C29H32O5
Exact Mass 460.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kc23uA71tiI
Name 2-(3,5-dimethoxybenzyl)-2-(3,5-dimethylbenzyl)2,3-dihydro-5,7-dimethoxy-1H-indene-1-one
CAS Registry Number 106116-47-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H32O5
InChI InChI=1S/C29H32O5/c1-18-7-19(2)9-20(8-18)15-29(16-21-10-23(31-3)13-24(11-21)32-4)17-22-12-25(33-5)14-26(34-6)27(22)28(29)30/h7-14H,15-17H2,1-6H3
InChIKey QKKNBIFXRIEVKE-UHFFFAOYSA-N
Molecular Weight 460.570 g/mol
SMILES C1(C(c2c(cc(cc2C1)OC)OC)=O)(Cc1cc(C)cc(c1)C)Cc1cc(OC)cc(c1)OC
SPLASH splash10-0pbc-1419000000-9bf88fd6956a24532006
Source of Spectrum K-120-593-12
Synonyms 2-(3,5-dimethoxybenzyl)-2-(3,5-dimethylbenzyl)-5,7-dimethoxy-1-indanone
Wiley ID 1390609