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1H-Inden-1-one, 3a,7a-dihydro-2,4,7,7a-tetrapentyl-
SpectraBase Compound ID 6q5VXnR4Faq
InChI InChI=1S/C29H48O/c1-5-9-13-17-24-20-21-26(19-15-11-7-3)29(22-16-12-8-4)27(24)23-25(28(29)30)18-14-10-6-2/h20-21,23,27H,5-19,22H2,1-4H3
InChIKey YERZZNTUDAEIKN-UHFFFAOYSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFCgrQKMaja
Name 1H-Inden-1-one, 3a,7a-dihydro-2,4,7,7a-tetrapentyl-
CAS Registry Number 124726-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-5-9-13-17-24-20-21-26(19-15-11-7-3)29(22-16-12-8-4)27(24)23-25(28(29)30)18-14-10-6-2/h20-21,23,27H,5-19,22H2,1-4H3
InChIKey YERZZNTUDAEIKN-UHFFFAOYSA-N
Molecular Weight 412.702 g/mol
SMILES C12(C(C=C(C2=O)CCCCC)C(CCCCC)=CC=C1CCCCC)CCCCC
SPLASH splash10-0006-1019200000-647a816896a48d876434
Source of Spectrum H-72-820-15
Synonyms 2,4,7,7a-tetrapentyl-3a,7a-dihydro-1H-inden-1-one 3a,7a-dihydro-2,4,7,7a-tetrapentyl-1H-inden-1-one
Wiley ID 1374789