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2-[2-(2-phenylethynyl)-1-cyclopentenyl]ethynylbenzene
SpectraBase Compound ID 1EnlV1ruSVh
InChI InChI=1S/C21H16/c1-3-8-18(9-4-1)14-16-20-12-7-13-21(20)17-15-19-10-5-2-6-11-19/h1-6,8-11H,7,12-13H2
InChIKey CSEUAIHZTGJIJL-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C21H16
Exact Mass 268.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2xBDGSyK4O
Name 2-[2-(2-phenylethynyl)-1-cyclopentenyl]ethynylbenzene
Alternate Name(s) 2-[2-(2-phenylethynyl)cyclopenten-1-yl]ethynylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C21H16
InChI InChI=1S/C21H16/c1-3-8-18(9-4-1)14-16-20-12-7-13-21(20)17-15-19-10-5-2-6-11-19/h1-6,8-11H,7,12-13H2
InChIKey CSEUAIHZTGJIJL-UHFFFAOYSA-N
Molecular Weight 268.359 g/mol
SMILES C(#Cc1ccccc1)C1=C(C#Cc2ccccc2)CCC1
SPLASH splash10-014i-0090000000-fa87d9b371573e6527db
Source of Spectrum U1-2001-3888-22
Wiley ID 815121