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(4R)-4-bromo-1,5-dimethyl-7-(4-methylphenyl)bicyclo[3.2.1]oct-6-en-2-one

View entire compound with spectra: 1 MS (GC)

(4R)-4-bromo-1,5-dimethyl-7-(4-methylphenyl)bicyclo[3.2.1]oct-6-en-2-one
SpectraBase Compound ID AWINd4U1Ux4
InChI InChI=1S/C17H19BrO/c1-11-4-6-12(7-5-11)13-9-16(2)10-17(13,3)15(19)8-14(16)18/h4-7,9,14H,8,10H2,1-3H3/t14-,16+,17+/m1/s1
InChIKey HQOGULJROHDMKR-ODIFPOPNSA-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 B3C2ZIosxTU
Name (4R)-4-bromo-1,5-dimethyl-7-(4-methylphenyl)bicyclo[3.2.1]oct-6-en-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19BrO
InChI InChI=1S/C17H19BrO/c1-11-4-6-12(7-5-11)13-9-16(2)10-17(13,3)15(19)8-14(16)18/h4-7,9,14H,8,10H2,1-3H3/t14-,16+,17+/m1/s1
InChIKey HQOGULJROHDMKR-ODIFPOPNSA-N
Molecular Weight 319.242 g/mol
SMILES [C@@]12(C(=C[C@@](C2)([C@](Br)(CC1=O)[H])C)c1ccc(cc1)C)C
SPLASH splash10-00ls-0924000000-8204b8249a39f24b2c11
Source of Spectrum KC-0-179-9
Synonyms (1S,4S,5R)-4-Bromo-1,5-dimethyl-7-(4-methylphenyl)bicyclo[3.2.1]oct-6-en-2-one
Wiley ID 787131