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2,4-DI-(4-CHLOROPHENYL)-CYCLOPENTADECYL-[D]-PYRIMIDINE
SpectraBase Compound ID 8JBCjzWBXeT
InChI InChI=1S/C29H34Cl2N2/c30-24-18-14-22(15-19-24)28-26-12-10-8-6-4-2-1-3-5-7-9-11-13-27(26)32-29(33-28)23-16-20-25(31)21-17-23/h14-21H,1-13H2
InChIKey OPPHXALVWCROGQ-UHFFFAOYSA-N
Mol Weight 481.5 g/mol
Molecular Formula C29H34Cl2N2
Exact Mass 480.209905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hHEulEwiTg
Name 17,19-bis(4-chloranylphenyl)-16,18-diazabicyclo[13.4.0]nonadeca-1(19),15,17-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H34Cl2N2
InChI InChI=1S/C29H34Cl2N2/c30-24-18-14-22(15-19-24)28-26-12-10-8-6-4-2-1-3-5-7-9-11-13-27(26)32-29(33-28)23-16-20-25(31)21-17-23/h14-21H,1-13H2
InChIKey OPPHXALVWCROGQ-UHFFFAOYSA-N
Instrument Name HP 5989A
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990115)13_1_79
Molecular Weight 481.511 g/mol
SMILES c1(nc2c(CCCCCCCCCCCCC2)c(n1)-c1ccc(cc1)Cl)-c1ccc(cc1)Cl
SPLASH splash10-004i-0005900000-f8ac3f8bd00085f5d96e
Source of Spectrum RCM-13-81-20
Wiley ID 1837850