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1,4-Bis(phenylethynyl)-1'-cyclopropyl)benzene
SpectraBase Compound ID 1mx2feGhin
InChI InChI=1S/C28H22/c1-3-7-23(8-4-1)15-17-27(19-20-27)25-11-13-26(14-12-25)28(21-22-28)18-16-24-9-5-2-6-10-24/h1-14H,19-22H2
InChIKey DHZKKVDCSOBWKT-UHFFFAOYSA-N
Mol Weight 358.48 g/mol
Molecular Formula C28H22
Exact Mass 358.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID P6GcLVI3U5
Name 1,4-Bis(phenylethynyl)-1'-cyclopropyl)benzene
Comments Less than 3 mono-isotopic peaks
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Formula C28H22
InChI InChI=1S/C28H22/c1-3-7-23(8-4-1)15-17-27(19-20-27)25-11-13-26(14-12-25)28(21-22-28)18-16-24-9-5-2-6-10-24/h1-14H,19-22H2
InChIKey DHZKKVDCSOBWKT-UHFFFAOYSA-N
Molecular Weight 358.484 g/mol
SMILES C1(C#Cc2ccccc2)(CC1)c1ccc(C2(C#Cc3ccccc3)CC2)cc1
SPLASH splash10-014i-0092000000-2a41bcea1cd244ccf8a0
Source of Spectrum F-62-2776-13
Wiley ID 1632575