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trans-(Z)-3-(5-(2-Bromoethyl)-4-octen-4-yl)-2-(1-hydroxy-1-phenylmethyl)cyclopentanone
SpectraBase Compound ID CjMjZHMiXZx
InChI InChI=1S/C22H31BrO2/c1-3-8-16(14-15-23)18(9-4-2)19-12-13-20(24)21(19)22(25)17-10-6-5-7-11-17/h5-7,10-11,19,21-22,25H,3-4,8-9,12-15H2,1-2H3/b18-16-/t19-,21-,22?/m1/s1
InChIKey FGHAIHYZMCJZEV-HCANKCPWSA-N
Mol Weight 407.39 g/mol
Molecular Formula C22H31BrO2
Exact Mass 406.150743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VKZ8LMar9o
Name trans-(Z)-3-(5-(2-Bromoethyl)-4-octen-4-yl)-2-(1-hydroxy-1-phenylmethyl)cyclopentanone
Alternate Name(s) (2S,3S)-3-[(1Z)-2-(2-bromoethyl)-1-propyl-1-pentenyl]-2-[hydroxy(phenyl)methyl]cyclopentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31BrO2
InChI InChI=1S/C22H31BrO2/c1-3-8-16(14-15-23)18(9-4-2)19-12-13-20(24)21(19)22(25)17-10-6-5-7-11-17/h5-7,10-11,19,21-22,25H,3-4,8-9,12-15H2,1-2H3/b18-16-/t19-,21-,22?/m1/s1
InChIKey FGHAIHYZMCJZEV-HCANKCPWSA-N
Molecular Weight 407.392 g/mol
SMILES OC([C@@]1([C@@](\C(=C/(CCBr)CCC)CCC)(CCC1=O)[H])[H])c1ccccc1
SPLASH splash10-0a4i-2945000000-0af65d8ae501030547c4
Source of Spectrum F-51-4418-0
Wiley ID 791565