(3E)-3-(4-Bromobenzylidene)-1,7,7-trimethylbicyclo[2.2.1]-heptan-2-one

SpectraBase Compound ID	BThgAELnFo8
InChI	InChI=1S/C17H19BrO/c1-16(2)14-8-9-17(16,3)15(19)13(14)10-11-4-6-12(18)7-5-11/h4-7,10,14H,8-9H2,1-3H3/b13-10+/t14-,17+/m1/s1
InChIKey	URDLFHPWAIEBNH-JLHYYAGUSA-N Google Search
Mol Weight	319.24 g/mol
Molecular Formula	C17H19BrO
Exact Mass	318.061928 g/mol

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SpectraBase Spectrum ID	4Xc0lgPZdA
Name	(3E)-3-(4-Bromobenzylidene)-1,7,7-trimethylbicyclo[2.2.1]-heptan-2-one
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H19BrO
InChI	InChI=1S/C17H19BrO/c1-16(2)14-8-9-17(16,3)15(19)13(14)10-11-4-6-12(18)7-5-11/h4-7,10,14H,8-9H2,1-3H3/b13-10+/t14-,17+/m1/s1
InChIKey	URDLFHPWAIEBNH-JLHYYAGUSA-N
Literature Reference DOI	10.1021/jo100763f
Molecular Weight	319.242 g/mol
SMILES	CC1([C@@]2(CC[C@@]1(C)C(=O)\C2=C/c1ccc(cc1)Br)[H])C
SPLASH	splash10-01di-0129000000-edae4399a3867342a832
Source of Spectrum	J-75-4374-25b
Synonyms	(1S,4S,E)-3-(4-bromobenzylidene)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Wiley ID	1746599