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1,1'-Biphenyl, 2-[1-[3-bromo-5-(1-methylethyl)phenyl]-1,3-butadienyl]-, (E)-
SpectraBase Compound ID HnVExOVJLpU
InChI InChI=1S/C25H23Br/c1-4-10-23(21-15-20(18(2)3)16-22(26)17-21)25-14-9-8-13-24(25)19-11-6-5-7-12-19/h4-18H,1H2,2-3H3/b23-10+
InChIKey XMOYVGNTCAXDQP-AUEPDCJTSA-N
Mol Weight 403.36 g/mol
Molecular Formula C25H23Br
Exact Mass 402.098314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2LF48hKMso
Name 1,1'-Biphenyl, 2-[1-[3-bromo-5-(1-methylethyl)phenyl]-1,3-butadienyl]-, (E)-
Alternate Name(s) (E)-1-(biphenyl-2'-yl)-1-(3''-bromo-5''-isopropylphenyl)buta-1,3-diene 2-[(1E)-1-(3-bromo-5-isopropylphenyl)-1,3-butadienyl]-1,1'-biphenyl
CAS Registry Number 112930-29-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23Br
InChI InChI=1S/C25H23Br/c1-4-10-23(21-15-20(18(2)3)16-22(26)17-21)25-14-9-8-13-24(25)19-11-6-5-7-12-19/h4-18H,1H2,2-3H3/b23-10+
InChIKey XMOYVGNTCAXDQP-AUEPDCJTSA-N
Molecular Weight 403.363 g/mol
SMILES c1(\C(c2c(-c3ccccc3)cccc2)=C/C=C)cc(C(C)C)cc(c1)Br
SPLASH splash10-0fsi-0190000000-17297898c90433ab9f7b
Source of Spectrum B-40-1121-12
Wiley ID 1370535