| SpectraBase Compound ID | 6T5vasGWZq9 |
|---|---|
| InChI | InChI=1S/C34H26Br6N4O9/c35-18-5-15-2-4-42-34(49)27(44-51)28(45)17-12-22(39)32(23(40)13-17)53-26-11-16(8-19(36)30(26)47)9-24(43-50)33(48)41-3-1-14-6-20(37)31(21(38)7-14)52-25(10-15)29(18)46/h5-8,10-13,28,45-47,50-51H,1-4,9H2,(H,41,48)(H,42,49)/b43-24+,44-27+ |
| InChIKey | MHAGECXZXFMEGD-OJYBBUQISA-N |
| Mol Weight | 1114.0 g/mol |
| Molecular Formula | C34H26Br6N4O9 |
| Exact Mass | 1107.680006 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BvYnxd483zQ |
|---|---|
| Name | Bastadin-24 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H26Br6N4O9 |
| InChI | InChI=1S/C34H26Br6N4O9/c35-18-5-15-2-4-42-34(49)27(44-51)28(45)17-12-22(39)32(23(40)13-17)53-26-11-16(8-19(36)30(26)47)9-24(43-50)33(48)41-3-1-14-6-20(37)31(21(38)7-14)52-25(10-15)29(18)46/h5-8,10-13,28,45-47,50-51H,1-4,9H2,(H,41,48)(H,42,49)/b43-24+,44-27+ |
| InChIKey | MHAGECXZXFMEGD-OJYBBUQISA-N |
| Molecular Weight | 1114.025 g/mol |
| SMILES | N1CCc2cc(c(c(c2)Oc2c(cc(CCNC(\C(Cc3cc(c(c(c3)Br)O)Oc3c(cc(C(\C(C1=O)=N/O)O)cc3Br)Br)=N/O)=O)cc2Br)Br)O)Br |
| SPLASH | splash10-052o-0010900000-8125f251d7ad365d61fb |
| Source of Spectrum | G4-71-311-1 |
| Wiley ID | 1695242 |