| SpectraBase Spectrum ID |
DbEZlqM2c4n |
| Name |
(1sr,3sr,4rs,7rs)-2,3,4,7-Tetrahydro-N-methyl-7-deuterio-3-phenylbenzo-[D]-2-aza-1-lambda(5)-phosphole-1-oxide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.134528011 u |
| Formula |
C20H19[2H]NOP |
| InChI |
InChI=1S/C20H20NOP/c1-21-20(16-10-4-2-5-11-16)18-14-8-9-15-19(18)23(21,22)17-12-6-3-7-13-17/h2-8,10-15,18,20H,9H2,1H3/t18-,20+,23+/m0/s1/i9D/t9-,18-,20+,23+ |
| InChIKey |
STMALCMZSDPHSP-OOGLZQOGSA-N |
| Molecular Weight |
322.366 g/mol |
| Nominal Mass |
322 u |
| SMILES |
C=12[P@](N([C@@]([C@]2(C=C[C@@](C1)([2H])[H])[H])(C1=CC=CC=C1)[H])C)(=O)C1=CC=CC=C1 |
![(1sr,3sr,4rs,7rs)-2,3,4,7-Tetrahydro-N-methyl-7-deuterio-3-phenylbenzo-[D]-2-aza-1-lambda(5)-phosphole-1-oxide](/api/spectrum/DbEZlqM2c4n/structure.png?h=300&w=458 "(1sr,3sr,4rs,7rs)-2,3,4,7-Tetrahydro-N-methyl-7-deuterio-3-phenylbenzo-[D]-2-aza-1-lambda(5)-phosphole-1-oxide")
