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7-Methyl-1,2,4,5-tetrahydro-3-H-benzocyclohepten-3-one -
SpectraBase Compound ID Jlil4lBlexQ
InChI InChI=1S/C12H14O/c1-9-2-3-10-4-6-12(13)7-5-11(10)8-9/h2-3,8H,4-7H2,1H3
InChIKey SUZBINQBXNUFGI-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIEAbiKpT3v
Name 7-Methyl-1,2,4,5-tetrahydro-3-H-benzocyclohepten-3-one -
Alternate Name(s) 3-Methyl-5,6,8,9-tetrahydrobenzo[7]annulen-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-9-2-3-10-4-6-12(13)7-5-11(10)8-9/h2-3,8H,4-7H2,1H3
InChIKey SUZBINQBXNUFGI-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES c12c(CCC(CC2)=O)ccc(c1)C
SPLASH splash10-0089-0900000000-6273f7add2f4308b737a
Source of Spectrum H-84-2062-23
Wiley ID 847713