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6-[(3-keto-2,5,6,7-tetrahydro-1H-s-indacen-2-yl)methyl]indane-5-carboxylic acid methyl ester
SpectraBase Compound ID IuHnF1QA3vc
InChI InChI=1S/C24H24O3/c1-27-24(26)22-13-17-7-3-5-15(17)9-19(22)11-20-10-18-8-14-4-2-6-16(14)12-21(18)23(20)25/h8-9,12-13,20H,2-7,10-11H2,1H3
InChIKey OICBITAPYYBEOU-UHFFFAOYSA-N
Mol Weight 360.45 g/mol
Molecular Formula C24H24O3
Exact Mass 360.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfhMxBZo23g
Name 6-[(3-keto-2,5,6,7-tetrahydro-1H-s-indacen-2-yl)methyl]indane-5-carboxylic acid methyl ester
Alternate Name(s) 6-[(3-oxo-2,5,6,7-tetrahydro-1H-s-indacen-2-yl)methyl]-2,3-dihydro-1H-indene-5-carboxylic acid methyl ester Methyl 6-[(3-oxidanylidene-2,5,6,7-tetrahydro-1H-s-indacen-2-yl)methyl]-2,3-dihydro-1H-indene-5-carboxylate Methyl 6-[(3-oxo-2,5,6,7-tetrahydro-1H-s-indacen-2-yl)methyl]-2,3-dihydro-1H-indene-5-carboxylate Methyl 6-[(3-oxo-2,5,6,7-tetrahydro-1H-s-indacen-2-yl)methyl]indane-5-carboxylate
CAS Registry Number 113364-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24O3
InChI InChI=1S/C24H24O3/c1-27-24(26)22-13-17-7-3-5-15(17)9-19(22)11-20-10-18-8-14-4-2-6-16(14)12-21(18)23(20)25/h8-9,12-13,20H,2-7,10-11H2,1H3
InChIKey OICBITAPYYBEOU-UHFFFAOYSA-N
Molecular Weight 360.453 g/mol
SMILES c12C(C(Cc3c(cc4c(c3)CCC4)C(=O)OC)Cc2cc2c(c1)CCC2)=O
SPLASH splash10-01t9-0109000000-0ae0eabbabffa5f85ec5
Source of Spectrum AH-118-652-20
Wiley ID 1348687