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3-(2-bromophenyl)-2,3,4,5,6,7,8,9-octahydrocyclopentacycloocten-1-one
SpectraBase Compound ID KUYipr2dThV
InChI InChI=1S/C17H19BrO/c18-16-10-6-5-8-13(16)15-11-17(19)14-9-4-2-1-3-7-12(14)15/h5-6,8,10,15H,1-4,7,9,11H2
InChIKey VAFKHVQZVPXBBO-UHFFFAOYSA-N
Mol Weight 319.24 g/mol
Molecular Formula C17H19BrO
Exact Mass 318.061928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcRvzH71NfN
Name 3-(2-bromophenyl)-2,3,4,5,6,7,8,9-octahydrocyclopentacycloocten-1-one
Alternate Name(s) 3-(2-bromophenyl)-2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[8]annulen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19BrO
InChI InChI=1S/C17H19BrO/c18-16-10-6-5-8-13(16)15-11-17(19)14-9-4-2-1-3-7-12(14)15/h5-6,8,10,15H,1-4,7,9,11H2
InChIKey VAFKHVQZVPXBBO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cctc.200900269
Molecular Weight 319.242 g/mol
SMILES C1CCCC=2C(CC(C2CC1)c1ccccc1Br)=O
SPLASH splash10-00ri-1469000000-9fadc317f6a5eb06ed23
Source of Spectrum CCC-2-519/SM4-3e
Wiley ID 1786878