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5-(p-Bromophenyl)-7,11,11-trimethyltricyclo[5.4.0.0(3,6)]undec-1-ene-4-one
SpectraBase Compound ID Lg0c88em0sr
InChI InChI=1S/C20H23BrO/c1-19(2)9-4-10-20(3)15(19)11-14-17(20)16(18(14)22)12-5-7-13(21)8-6-12/h5-8,11,14,16-17H,4,9-10H2,1-3H3
InChIKey VQAKZCHJDZTYQW-UHFFFAOYSA-N
Mol Weight 359.31 g/mol
Molecular Formula C20H23BrO
Exact Mass 358.093228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZEYoakju2t
Name 5-(p-Bromophenyl)-7,11,11-trimethyltricyclo[5.4.0.0(3,6)]undec-1-ene-4-one
Alternate Name(s) 2-(4-bromophenyl)-2b,6,6-trimethyl-2,2a,2b,3,4,5,6,7a-octahydro-1H-cyclobuta[a]inden-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23BrO
InChI InChI=1S/C20H23BrO/c1-19(2)9-4-10-20(3)15(19)11-14-17(20)16(18(14)22)12-5-7-13(21)8-6-12/h5-8,11,14,16-17H,4,9-10H2,1-3H3
InChIKey VQAKZCHJDZTYQW-UHFFFAOYSA-N
Molecular Weight 359.307 g/mol
SMILES C12=CC3C(C(C3C1(CCCC2(C)C)C)c1ccc(cc1)Br)=O
SPLASH splash10-015a-0179000000-398eca155199f1f01e8d
Source of Spectrum J-67-2238-5
Wiley ID 1569382