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1-(2'-Nitrophenyl)-2-phenylacetylene
SpectraBase Compound ID JAEmmcY4kAP
InChI InChI=1S/C14H9NO2/c16-15(17)14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-9H
InChIKey OXTHQALUIYPPEV-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C14H9NO2
Exact Mass 223.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LCMJjlKFNte
Name 1-(2'-Nitrophenyl)-2-phenylacetylene
Alternate Name(s) 1-Nitro-2-(2-phenylethynyl)benzene 4-Nitrodiphenylacetylene 1-Nitro-2-phenylethynylbenzene 1-Nitro-2-(phenylethynyl)benzene
CAS Registry Number 35010-17-4
Comments Less than 3 mono-isotopic peaks
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Formula C14H9NO2
InChI InChI=1S/C14H9NO2/c16-15(17)14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-9H
InChIKey OXTHQALUIYPPEV-UHFFFAOYSA-N
Molecular Weight 223.231 g/mol
SMILES c1(N(=O)=O)c(C#Cc2ccccc2)cccc1
SPLASH splash10-00di-0190000000-07f26bbce5e2cacc44c2
Source of Spectrum SK-32-1943-3
Wiley ID 1548733