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1-Bromanyl-2-hept-1-ynyl-3-nitro-benzene
SpectraBase Compound ID AS88g1vpxcU
InChI InChI=1S/C13H14BrNO2/c1-2-3-4-5-6-8-11-12(14)9-7-10-13(11)15(16)17/h7,9-10H,2-5H2,1H3
InChIKey LFFTYNIUINJGAZ-UHFFFAOYSA-N
Mol Weight 296.16 g/mol
Molecular Formula C13H14BrNO2
Exact Mass 295.020792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ed5tyqhCAjP
Name 1-Bromanyl-2-hept-1-ynyl-3-nitro-benzene
CAS Registry Number 121866-21-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrNO2
InChI InChI=1S/C13H14BrNO2/c1-2-3-4-5-6-8-11-12(14)9-7-10-13(11)15(16)17/h7,9-10H,2-5H2,1H3
InChIKey LFFTYNIUINJGAZ-UHFFFAOYSA-N
Molecular Weight 296.164 g/mol
SMILES c1(N(=O)=O)c(C#CCCCCC)c(Br)ccc1
SPLASH splash10-004j-0960000000-28013051f9ded21f4465
Source of Spectrum J-54-4456-5
Synonyms 1-Bromo-2-(1-heptynyl)-3-nitrobenzene 1-Bromo-2-hept-1-ynyl-3-nitro-benzene
Wiley ID 1297992