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1-(4-Bromophenyl)ethyl isocyanate
SpectraBase Compound ID uwaFPoBE5H
InChI InChI=1S/C9H8BrNO/c1-7(11-6-12)8-2-4-9(10)5-3-8/h2-5,7H,1H3
InChIKey AKVAGWOVWQDTAF-UHFFFAOYSA-N
Mol Weight 226.07 g/mol
Molecular Formula C9H8BrNO
Exact Mass 224.978927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DyCrRq26RD
Name 1-(4-Bromophenyl)ethyl isocyanate
Alternate Name(s) 1-Bromanyl-4-(1-isocyanatoethyl)benzene 1-Bromo-4-(1-isocyanatoethyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8BrNO
InChI InChI=1S/C9H8BrNO/c1-7(11-6-12)8-2-4-9(10)5-3-8/h2-5,7H,1H3
InChIKey AKVAGWOVWQDTAF-UHFFFAOYSA-N
Molecular Weight 226.073 g/mol
SMILES C(C)(c1ccc(cc1)Br)N=C=O
SPLASH splash10-03di-0090000000-cc84ace07e43ec677bf2
Source of Spectrum ES-2005-2996-21
Wiley ID 1563520