| SpectraBase Spectrum ID |
4TyI3njSmtd |
| Name |
(5R,8S)-5,8-bis(2-tert-butyl-3,3-dimethyl-but-1-enyl)-2-phenyl-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H47N3O2 |
| InChI |
InChI=1S/C32H47N3O2/c1-29(2,3)25(30(4,5)6)20-23-18-19-24(21-26(31(7,8)9)32(10,11)12)35-28(37)33(27(36)34(23)35)22-16-14-13-15-17-22/h13-21,23-24H,1-12H3/t23-,24+ |
| InChIKey |
MPOLKIQDLBTITB-PSWAGMNNSA-N |
| Instrument Name |
FINNIGAN MAT 90x |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.11.139 |
| Molecular Weight |
505.747 g/mol |
| Reported Formula |
C32H47N3O2 |
| SMILES |
C(=C[C@]1(C=C[C@@](C=C(C(C)(C)C)C(C)(C)C)(N2C(N(C(=O)N12)c1ccccc1)=O)[H])[H])(C(C)(C)C)C(C)(C)C |
| SPLASH |
splash10-05fr-3090310000-37c35d4d93c99931de57 |
| Source of Spectrum |
BJO-11-SM16-37 |
| Wiley ID |
1851505 |
![(5R,8S)-5,8-bis(2-tert-butyl-3,3-dimethyl-but-1-enyl)-2-phenyl-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione](/api/spectrum/4TyI3njSmtd/structure.png?h=300&w=458 "(5R,8S)-5,8-bis(2-tert-butyl-3,3-dimethyl-but-1-enyl)-2-phenyl-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione")
