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2,4-DI-(4-CHLOROPHENYL)-CYCLOOCTYL-[D]-PYRIMIDINE
SpectraBase Compound ID 6zZA9EJWLyD
InChI InChI=1S/C22H20Cl2N2/c23-17-11-7-15(8-12-17)21-19-5-3-1-2-4-6-20(19)25-22(26-21)16-9-13-18(24)14-10-16/h7-14H,1-6H2
InChIKey VATJHJUELAACIG-UHFFFAOYSA-N
Mol Weight 383.32 g/mol
Molecular Formula C22H20Cl2N2
Exact Mass 382.100354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ckm7XcTIEn
Name 2,4-bis(4-chloranylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20Cl2N2
InChI InChI=1S/C22H20Cl2N2/c23-17-11-7-15(8-12-17)21-19-5-3-1-2-4-6-20(19)25-22(26-21)16-9-13-18(24)14-10-16/h7-14H,1-6H2
InChIKey VATJHJUELAACIG-UHFFFAOYSA-N
Instrument Name HP 5989A
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990115)13_1_79
Molecular Weight 383.322 g/mol
SMILES c1(nc2c(c(n1)-c1ccc(cc1)Cl)CCCCCC2)-c1ccc(cc1)Cl
SPLASH splash10-001i-0009000000-0a8e03a9eaf7bd1c3078
Source of Spectrum RCM-13-80-17
Wiley ID 1837846