John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=EHCE54Xb3Jb

(accessed ).
WCTVOCDBSMJOPH-UHFFFAOYSA-M
SpectraBase Compound ID EHCE54Xb3Jb
InChI InChI=1S/C28H28N7.BrH/c29-27-26-28(31-19-30-27)35(20-32-26)18-22-5-9-24(10-6-22)23-7-3-21(4-8-23)17-33-15-11-25(12-16-33)34-13-1-2-14-34;/h3-12,15-16,19-20H,1-2,13-14,17-18H2,(H2,29,30,31);1H/q+1;/p-1
InChIKey WCTVOCDBSMJOPH-UHFFFAOYSA-M
Mol Weight 542.49 g/mol
Molecular Formula C28H28BrN7
Exact Mass 541.158955 g/mol
Parent InChIKey IURGSLJXWFCKLO-UHFFFAOYSA-M
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