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4-{4-[11-Bromoundecyl)oxy]phenyl}benzonitrile
SpectraBase Compound ID LT49bIFupZE
InChI InChI=1S/C24H30BrNO/c25-18-8-6-4-2-1-3-5-7-9-19-27-24-16-14-23(15-17-24)22-12-10-21(20-26)11-13-22/h10-17H,1-9,18-19H2
InChIKey HSHJPUGXKBBFSM-UHFFFAOYSA-N
Mol Weight 428.41 g/mol
Molecular Formula C24H30BrNO
Exact Mass 427.151078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9X8w3tfIOq6
Name 4-{4-[11-Bromoundecyl)oxy]phenyl}benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30BrNO
InChI InChI=1S/C24H30BrNO/c25-18-8-6-4-2-1-3-5-7-9-19-27-24-16-14-23(15-17-24)22-12-10-21(20-26)11-13-22/h10-17H,1-9,18-19H2
InChIKey HSHJPUGXKBBFSM-UHFFFAOYSA-N
Molecular Weight 428.414 g/mol
SMILES C(#N)c1ccc(-c2ccc(cc2)OCCCCCCCCCCCBr)cc1
SPLASH splash10-002b-0900700000-d21b6aa8bb59a00ea908
Source of Spectrum QE-7-3276-20
Synonyms 4-[4-(11-Bromanylundecoxy)phenyl]benzenecarbonitrile
Wiley ID 845739