| SpectraBase Spectrum ID |
KX6KuBRI9KK |
| Name |
11-Methoxy-2-[2-N,N-(dimethylamid)ethenyl]pyrrolo[2,1-C][1,4]benzodazepine-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.158291545 u |
| Formula |
C18H21N3O3 |
| InChI |
InChI=1S/C18H21N3O3/c1-20(2)16(22)9-8-12-10-15-17(24-3)19-14-7-5-4-6-13(14)18(23)21(15)11-12/h4-9,11,15,17,19H,10H2,1-3H3/b9-8+/t15?,17-/m1/s1 |
| InChIKey |
FGOMIZGTJVIKHX-CIFLTQILSA-N |
| Molecular Weight |
327.384 g/mol |
| SMILES |
C1(N2C([C@](NC=3C1=CC=CC3)(OC)[H])CC(=C2)\C=C\C(N(C)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871023 |
![11-Methoxy-2-[2-N,N-(dimethylamid)ethenyl]pyrrolo[2,1-c][1,4]benzodazepine-5-one](/api/spectrum/KX6KuBRI9KK/structure.png?h=300&w=458 "11-Methoxy-2-[2-N,N-(dimethylamid)ethenyl]pyrrolo[2,1-c][1,4]benzodazepine-5-one")
