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2,4-bis(4-chlorophenyl)-5-methyl-6-pentylpyrimidine
SpectraBase Compound ID 5Yb3qAyif34
InChI InChI=1S/C22H22Cl2N2/c1-3-4-5-6-20-15(2)21(16-7-11-18(23)12-8-16)26-22(25-20)17-9-13-19(24)14-10-17/h7-14H,3-6H2,1-2H3
InChIKey TXHWUJRJPIORHP-UHFFFAOYSA-N
Mol Weight 385.34 g/mol
Molecular Formula C22H22Cl2N2
Exact Mass 384.116004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COZiDYwO7A5
Name 2,4-bis(4-chlorophenyl)-5-methyl-6-pentylpyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22Cl2N2
InChI InChI=1S/C22H22Cl2N2/c1-3-4-5-6-20-15(2)21(16-7-11-18(23)12-8-16)26-22(25-20)17-9-13-19(24)14-10-17/h7-14H,3-6H2,1-2H3
InChIKey TXHWUJRJPIORHP-UHFFFAOYSA-N
Instrument Name HP 5989A
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19991230)13_24_2480
Molecular Weight 385.338 g/mol
SMILES c1(nc(c(c(n1)-c1ccc(cc1)Cl)C)CCCCC)-c1ccc(cc1)Cl
SPLASH splash10-004i-0009000000-9ee738d6cb7620c8840f
Source of Spectrum RCM-13-2482-16
Wiley ID 1839013