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Benzene, 1-(4-bromo-1-butynyl)-2-(1-octynyl)-

View entire compound with spectra: 1 MS (GC)

Benzene, 1-(4-bromo-1-butynyl)-2-(1-octynyl)-
SpectraBase Compound ID DcZrHrCIThw
InChI InChI=1S/C18H21Br/c1-2-3-4-5-6-7-12-17-13-8-9-14-18(17)15-10-11-16-19/h8-9,13-14H,2-6,11,16H2,1H3
InChIKey MWBNXXPDULXDLE-UHFFFAOYSA-N
Mol Weight 317.27 g/mol
Molecular Formula C18H21Br
Exact Mass 316.082664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5JWqbTcc2R
Name Benzene, 1-(4-bromo-1-butynyl)-2-(1-octynyl)-
CAS Registry Number 121221-96-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21Br
InChI InChI=1S/C18H21Br/c1-2-3-4-5-6-7-12-17-13-8-9-14-18(17)15-10-11-16-19/h8-9,13-14H,2-6,11,16H2,1H3
InChIKey MWBNXXPDULXDLE-UHFFFAOYSA-N
Molecular Weight 317.270 g/mol
SMILES C(#CCCCCCC)c1c(C#CCCBr)cccc1
SPLASH splash10-014i-0902000000-028dadfaebc8c52770dc
Source of Spectrum KC-1989-481-28
Synonyms 1-(4-bromo-1-butynyl)-2-(1-octynyl)benzene 1-(4-Bromobut-1-ynyl)-2-(oct-1-yny)benzene
Wiley ID 1316825