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Benzene, 1-[(4-chlorophenyl)ethynyl]-2-nitro-
SpectraBase Compound ID 7LsVIqrNCKy
InChI InChI=1S/C14H8ClNO2/c15-13-9-6-11(7-10-13)5-8-12-3-1-2-4-14(12)16(17)18/h1-4,6-7,9-10H
InChIKey MYPKXULGMPMATF-UHFFFAOYSA-N
Mol Weight 257.68 g/mol
Molecular Formula C14H8ClNO2
Exact Mass 257.024356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Voq4uZnw7I
Name Benzene, 1-[(4-chlorophenyl)ethynyl]-2-nitro-
CAS Registry Number 121387-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8ClNO2
InChI InChI=1S/C14H8ClNO2/c15-13-9-6-11(7-10-13)5-8-12-3-1-2-4-14(12)16(17)18/h1-4,6-7,9-10H
InChIKey MYPKXULGMPMATF-UHFFFAOYSA-N
Molecular Weight 257.676 g/mol
SMILES c1(N(=O)=O)c(C#Cc2ccc(cc2)Cl)cccc1
SPLASH splash10-000i-0940000000-f6ee2e6b20ddc00c29b0
Source of Spectrum O-24-67-5
Synonyms 1-(2-Nitrophenyl)-2-(4-chlorophenyl)-acetylene 1-[(4-chlorophenyl)ethynyl]-2-nitrobenzene
Wiley ID 1260738