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4-(3-Methoxyprop-1-ynyl)-5,6-dimethyl-2-(5-phenylpent-1-ynyl)pyrimidine

View entire compound with spectra: 1 MS (GC)

4-(3-Methoxyprop-1-ynyl)-5,6-dimethyl-2-(5-phenylpent-1-ynyl)pyrimidine
SpectraBase Compound ID B5QOFTU0LG0
InChI InChI=1S/C21H22N2O/c1-17-18(2)22-21(23-20(17)14-10-16-24-3)15-9-5-8-13-19-11-6-4-7-12-19/h4,6-7,11-12H,5,8,13,16H2,1-3H3
InChIKey KBHYMOLSPXPPHB-UHFFFAOYSA-N
Mol Weight 318.42 g/mol
Molecular Formula C21H22N2O
Exact Mass 318.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KOmB3mJ9qqd
Name 4-(3-Methoxyprop-1-ynyl)-5,6-dimethyl-2-(5-phenylpent-1-ynyl)pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O
InChI InChI=1S/C21H22N2O/c1-17-18(2)22-21(23-20(17)14-10-16-24-3)15-9-5-8-13-19-11-6-4-7-12-19/h4,6-7,11-12H,5,8,13,16H2,1-3H3
InChIKey KBHYMOLSPXPPHB-UHFFFAOYSA-N
Molecular Weight 318.420 g/mol
SMILES c1(nc(c(c(n1)C#CCOC)C)C)C#CCCCc1ccccc1
SPLASH splash10-03dl-6092000000-a2db076971309c625b66
Source of Spectrum F-69-5643-3
Wiley ID 1595458