| SpectraBase Spectrum ID |
KFkQ93fIG1A |
| Name |
o-(1,5-Diacetyl-7,8-dimethyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-yl)phenol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.178692638 u |
| Formula |
C21H24N2O3 |
| InChI |
InChI=1S/C21H24N2O3/c1-13-11-19-20(12-14(13)2)23(16(4)25)18(9-10-22(19)15(3)24)17-7-5-6-8-21(17)26/h5-8,11-12,18,26H,9-10H2,1-4H3 |
| InChIKey |
RAZAHOCJDHPKMP-UHFFFAOYSA-N |
| Molecular Weight |
352.434 g/mol |
| SMILES |
OC1=C(C2CCN(C3=C(N2C(=O)C)C=C(C(=C3)C)C)C(C)=O)C=CC=C1 |
