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(1S,4R,5R)-4-Bromo-1,5-dimethyl-7-(2-methoxyphenyl)bicyclo[3.2.1]oct-6-en-2-one

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(1S,4R,5R)-4-Bromo-1,5-dimethyl-7-(2-methoxyphenyl)bicyclo[3.2.1]oct-6-en-2-one
SpectraBase Compound ID CeKhbT5w6SJ
InChI InChI=1S/C17H19BrO2/c1-16-9-12(11-6-4-5-7-13(11)20-3)17(2,10-16)15(19)8-14(16)18/h4-7,9,14H,8,10H2,1-3H3/t14-,16+,17+/m1/s1
InChIKey AZSLMOJQVQTMQD-PVAVHDDUSA-N
Mol Weight 335.24 g/mol
Molecular Formula C17H19BrO2
Exact Mass 334.056843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sTLasuz0i
Name (1S,4R,5R)-4-Bromo-1,5-dimethyl-7-(2-methoxyphenyl)bicyclo[3.2.1]oct-6-en-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19BrO2
InChI InChI=1S/C17H19BrO2/c1-16-9-12(11-6-4-5-7-13(11)20-3)17(2,10-16)15(19)8-14(16)18/h4-7,9,14H,8,10H2,1-3H3/t14-,16+,17+/m1/s1
InChIKey AZSLMOJQVQTMQD-PVAVHDDUSA-N
Molecular Weight 335.241 g/mol
SMILES C=1([C@]2(C(C[C@]([C@](C1)(C)C2)(Br)[H])=O)C)c1c(OC)cccc1
SPLASH splash10-03di-0093000000-1a15917f6ab6b066de9a
Source of Spectrum KC-0-180-10
Synonyms (1S,4R,5R)-4-bromo-7-(2-methoxyphenyl)-1,5-dimethylbicyclo[3.2.1]oct-6-en-2-one
Wiley ID 787125