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1,4-bis(p-Neopentoxyphenyl)-1,3-butadiyne
SpectraBase Compound ID 6Mb5AbGGcgV
InChI InChI=1S/C26H30O2/c1-25(2,3)19-27-23-15-11-21(12-16-23)9-7-8-10-22-13-17-24(18-14-22)28-20-26(4,5)6/h11-18H,19-20H2,1-6H3
InChIKey DDDQDHTUFDOQGR-UHFFFAOYSA-N
Mol Weight 374.52 g/mol
Molecular Formula C26H30O2
Exact Mass 374.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTYhkiuBFsi
Name 1,4-bis(p-Neopentoxyphenyl)-1,3-butadiyne
Alternate Name(s) 1-(neopentyloxy)-4-{4-[4-(neopentyloxy)phenyl]-1,3-butadiynyl}benzene
Comments Less than 3 mono-isotopic peaks
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Formula C26H30O2
InChI InChI=1S/C26H30O2/c1-25(2,3)19-27-23-15-11-21(12-16-23)9-7-8-10-22-13-17-24(18-14-22)28-20-26(4,5)6/h11-18H,19-20H2,1-6H3
InChIKey DDDQDHTUFDOQGR-UHFFFAOYSA-N
Molecular Weight 374.524 g/mol
SMILES C(C#Cc1ccc(OCC(C)(C)C)cc1)#Cc1ccc(OCC(C)(C)C)cc1
SPLASH splash10-0089-0096000000-3adcaf35ebbdc2bcee69
Source of Spectrum I-79-885-21
Wiley ID 813052