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2,4-di(4-methylphenyl)-5-propyl-6-(1,1-dideutero)butylpyrimidine
SpectraBase Compound ID Djta0ASxKuv
InChI InChI=1S/C25H30N2/c1-5-7-9-23-22(8-6-2)24(20-14-10-18(3)11-15-20)27-25(26-23)21-16-12-19(4)13-17-21/h10-17H,5-9H2,1-4H3/i9D2
InChIKey DPJPTLWVHUIYNC-KNXIQCGSSA-N
Mol Weight 360.54 g/mol
Molecular Formula C25H28D2N2
Exact Mass 360.253452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DL1tU0nvopq
Name 2,4-di(4-methylphenyl)-5-propyl-6-(1,1-dideutero)butylpyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28D2N2
InChI InChI=1S/C25H30N2/c1-5-7-9-23-22(8-6-2)24(20-14-10-18(3)11-15-20)27-25(26-23)21-16-12-19(4)13-17-21/h10-17H,5-9H2,1-4H3/i9D2
InChIKey DPJPTLWVHUIYNC-KNXIQCGSSA-N
Instrument Name HP 5989A
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19991230)13_24_2480
Molecular Weight 360.541 g/mol
SMILES c1(nc(c(c(n1)-c1ccc(cc1)C)CCC)C(CCC)([D])[D])-c1ccc(cc1)C
SPLASH splash10-0gb9-0219000000-456b8a892341b3d779bd
Source of Spectrum RCM-13-2488-34
Wiley ID 1839032