| SpectraBase Spectrum ID |
IjDYYVjDmGi |
| Name |
5-Tert-butyl-2,3-dimethoxycarbonyl-5,6-dihydropyrrolo(1,2-d)(1,2,4)triazocin-6-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19N3O5 |
| InChI |
InChI=1S/C16H19N3O5/c1-16(2,3)19-15(22)18-8-6-7-10(18)9-11(13(20)23-4)12(17-19)14(21)24-5/h6-9H,1-5H3/b11-9+,17-12+ |
| InChIKey |
ZXJAGBZHYUDHNH-KAZNXQFFSA-N |
| Ionization Type |
EI-B |
| Molecular Weight |
333.344 g/mol |
| SMILES |
COC(=O)\C1=C\c2[n](C(N(\N=C/1C(=O)OC)C(C)(C)C)=O)ccc2 |
| SPLASH |
splash10-0a4l-6961000000-6d2b2d5ada56a887c5db |
| Source of Spectrum |
SRH-2022-11861-0 |
| Wiley ID |
1833408 |
