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2,2-bis(3,5-dimethylbenzyl)-2,3-dihydro-5,7-dimethoxy-1H-indene-1-one
SpectraBase Compound ID Bv4CmDFILxv
InChI InChI=1S/C29H32O3/c1-18-7-19(2)10-22(9-18)15-29(16-23-11-20(3)8-21(4)12-23)17-24-13-25(31-5)14-26(32-6)27(24)28(29)30/h7-14H,15-17H2,1-6H3
InChIKey LSQQKFCYYVYKET-UHFFFAOYSA-N
Mol Weight 428.6 g/mol
Molecular Formula C29H32O3
Exact Mass 428.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tcPLyzf1YR
Name 2,2-bis(3,5-dimethylbenzyl)-2,3-dihydro-5,7-dimethoxy-1H-indene-1-one
CAS Registry Number 106116-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H32O3
InChI InChI=1S/C29H32O3/c1-18-7-19(2)10-22(9-18)15-29(16-23-11-20(3)8-21(4)12-23)17-24-13-25(31-5)14-26(32-6)27(24)28(29)30/h7-14H,15-17H2,1-6H3
InChIKey LSQQKFCYYVYKET-UHFFFAOYSA-N
Molecular Weight 428.572 g/mol
SMILES C1(C(c2c(cc(cc2C1)OC)OC)=O)(Cc1cc(C)cc(c1)C)Cc1cc(C)cc(c1)C
SPLASH splash10-0udi-0109000000-2344c3c8b703813d34de
Source of Spectrum K-120-593-12
Synonyms 2,2-bis(3,5-dimethylbenzyl)-5,7-dimethoxy-1-indanone
Wiley ID 1380909