For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

5-(5-Benzyloxycarbonyl-3,4-dimethylpyrrol-2-ylmethyl)-5'-benzyloxycarbonyl-3,3',4,4'-tetramethyl-2,2'-dipyrromethylene hydrobromide

View entire compound with spectra: 1 MS (GC)

5-(5-Benzyloxycarbonyl-3,4-dimethylpyrrol-2-ylmethyl)-5'-benzyloxycarbonyl-3,3',4,4'-tetramethyl-2,2'-dipyrromethylene hydrobromide
SpectraBase Compound ID JcSZS3pjdtC
InChI InChI=1S/C36H37N3O4.BrH/c1-21-22(2)30(18-32-24(4)26(6)34(39-32)36(41)43-20-28-15-11-8-12-16-28)37-29(21)17-31-23(3)25(5)33(38-31)35(40)42-19-27-13-9-7-10-14-27;/h7-18,37-39H,19-20H2,1-6H3;1H/b29-17-,30-18-;
InChIKey NPBYAWSJUYHCHD-LAAYSBGUSA-N
Mol Weight 656.6 g/mol
Molecular Formula C36H38BrN3O4
Exact Mass 655.20457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Iy30WepjKA6
Name 5-(5-Benzyloxycarbonyl-3,4-dimethylpyrrol-2-ylmethyl)-5'-benzyloxycarbonyl-3,3',4,4'-tetramethyl-2,2'-dipyrromethylene hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H38BrN3O4
InChI InChI=1S/C36H37N3O4.BrH/c1-21-22(2)30(18-32-24(4)26(6)34(39-32)36(41)43-20-28-15-11-8-12-16-28)37-29(21)17-31-23(3)25(5)33(38-31)35(40)42-19-27-13-9-7-10-14-27;/h7-18,37-39H,19-20H2,1-6H3;1H/b29-17-,30-18-;
InChIKey NPBYAWSJUYHCHD-LAAYSBGUSA-N
Molecular Weight 656.621 g/mol
SMILES [Br-].[NH2+]1\C(=C/c2c(c(c([nH]2)C(OCc2ccccc2)=O)C)C)C(=C(C)\C1=C/c1[nH]c(c(c1C)C)C(OCc1ccccc1)=O)C
SPLASH splash10-0006-9322000000-04236d1feb9be4d4c38a
Source of Spectrum H1-41-2559-6
Wiley ID 757383