| SpectraBase Spectrum ID |
45NgR7La6Pc |
| Name |
2-[[5-[(benzyloxy)carbonyl]-3,4-dimethyl-2-pyrryl]methylene]-5-[(benzyloxy)carbonyl]-3,4-dimethylisopyrrole bromide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H29BrN2O4 |
| InChI |
InChI=1S/C29H28N2O4.BrH/c1-19-20(2)27(29(33)35-18-24-13-9-6-10-14-24)30-26(19)16-31-15-25(21(3)22(31)4)28(32)34-17-23-11-7-5-8-12-23;/h5-16H,17-18H2,1-4H3;1H |
| InChIKey |
AYKXGGNOOCAZLT-UHFFFAOYSA-N |
| Molecular Weight |
549.465 g/mol |
| SMILES |
[Br-].[nH]1c(c(c(c1C(OCc1ccccc1)=O)C)C)\C=[n+]/1cc(C(OCc2ccccc2)=O)c(c1C)C |
| SPLASH |
splash10-0006-9000400000-774addc0541001fb2e66 |
| Source of Spectrum |
J-54-1947-30 |
| Synonyms |
(1E)-4-[(benzyloxy)carbonyl]-1-({5-[(benzyloxy)carbonyl]-3,4-dimethyl-1H-pyrrol-2-yl}methylene)-2,3-dimethyl-1H-pyrrolium bromide |
| Wiley ID |
1405439 |
![2-[[5-[(benzyloxy)carbonyl]-3,4-dimethyl-2-pyrryl]methylene]-5-[(benzyloxy)carbonyl]-3,4-dimethylisopyrrole bromide](/api/spectrum/45NgR7La6Pc/structure.png?h=300&w=458 "2-[[5-[(benzyloxy)carbonyl]-3,4-dimethyl-2-pyrryl]methylene]-5-[(benzyloxy)carbonyl]-3,4-dimethylisopyrrole bromide")
