| SpectraBase Spectrum ID |
GCEAJreZX6w |
| Name |
N1,N3-bis((cyclohexylcarbamoyl)(4-nitrophenyl)methyl)-2-cyclopentylidene-N1,N3-diphenylmalonamide |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C48H52N6O8 |
| InChI |
InChI=1S/C48H52N6O8/c55-45(49-36-17-5-1-6-18-36)43(34-25-29-40(30-26-34)53(59)60)51(38-21-9-3-10-22-38)47(57)42(33-15-13-14-16-33)48(58)52(39-23-11-4-12-24-39)44(35-27-31-41(32-28-35)54(61)62)46(56)50-37-19-7-2-8-20-37/h3-4,9-12,21-32,36-37,43-44H,1-2,5-8,13-20H2,(H,49,55)(H,50,56) |
| InChIKey |
LZZIDCHHEJFRFB-UHFFFAOYSA-N |
| Instrument Name |
Agilent Technologies HP-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.jscs.2015.07.008 |
| Molecular Weight |
840.978 g/mol |
| SMILES |
N(C(C(N(C(C(C(N(C(C(NC1CCCCC1)=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)=O)=C1CCCC1)=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-])=O)C1CCCCC1 |
| SPLASH |
splash10-004i-7691000000-0adf40395e5e0a51632f |
| Source of Spectrum |
SCS-21-301-8b |
| Wiley ID |
1857620 |
