| SpectraBase Spectrum ID |
5NZjLWbXejB |
| Name |
1,2,3,4,5,6-Hexahydro-1,5-imino-9-methoxy-3,8,11-trimethyl-10-nitro-4-oxo-3-benzazocine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.137556100 u |
| Formula |
C15H19N3O4 |
| InChI |
InChI=1S/C15H19N3O4/c1-8-5-9-6-10-15(19)16(2)7-11(17(10)3)12(9)13(18(20)21)14(8)22-4/h5,10-11H,6-7H2,1-4H3/t10-,11-/m0/s1 |
| InChIKey |
IOJBKYCCORHJAG-QWRGUYRKSA-N |
| Molecular Weight |
305.334 g/mol |
| SMILES |
C1(=C2[C@]3(N(C)[C@@](CC2=CC(=C1OC)C)(C(=O)N(C3)C)[H])[H])N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925485 |
