| SpectraBase Spectrum ID |
6QcEmzMD7yS |
| Name |
(3R)-5-(2-Fluorophenyl)-1,3-dihydro-3-(1H-indol-3-ylmethyl)-1-methyl-2H-1,4-benzodiazepin-2-one, tms |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
469.198567231 u |
| Formula |
C28H28FN3OSi |
| InChI |
InChI=1S/C28H28FN3OSi/c1-31-25-15-9-7-13-22(25)27(21-12-5-8-14-23(21)29)30-24(28(31)33)17-19-18-32(34(2,3)4)26-16-10-6-11-20(19)26/h5-16,18,24H,17H2,1-4H3/t24-/m1/s1 |
| InChIKey |
TWVHMSWOWNMAKH-XMMPIXPASA-N |
| Molecular Weight |
469.635 g/mol |
| SMILES |
C1(F)=C(C=CC=C1)C1=N[C@@]([H])(C(=O)N(C=2C1=CC=CC2)C)CC=1C2=C(N(C1)[Si](C)(C)C)C=CC=C2 |
