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3-isopropyl-5,6,8,9-tetrahydrobenzocyclohepten-7-one
SpectraBase Compound ID 3b4bVvRB94Y
InChI InChI=1S/C14H18O/c1-10(2)12-4-3-11-5-7-14(15)8-6-13(11)9-12/h3-4,9-10H,5-8H2,1-2H3
InChIKey LROYJMMGXGZTFI-UHFFFAOYSA-N
Mol Weight 202.3 g/mol
Molecular Formula C14H18O
Exact Mass 202.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fbQNRRa3sD
Name 3-isopropyl-5,6,8,9-tetrahydrobenzocyclohepten-7-one
Alternate Name(s) 3-isopropyl-5,6,8,9-tetrahydrobenzo[7]annulen-7-one 3-Propan-2-yl-5,6,8,9-tetrahydrobenzo[7]annulen-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O
InChI InChI=1S/C14H18O/c1-10(2)12-4-3-11-5-7-14(15)8-6-13(11)9-12/h3-4,9-10H,5-8H2,1-2H3
InChIKey LROYJMMGXGZTFI-UHFFFAOYSA-N
Molecular Weight 202.297 g/mol
SMILES c12c(CCC(CC2)=O)cc(cc1)C(C)C
SPLASH splash10-000i-1920000000-5d472901261e93d6f74a
Source of Spectrum H-90-1264-11
Wiley ID 1590733