| SpectraBase Spectrum ID |
AXq8CF12I7R |
| Name |
3-Phenyl-8-iodoperhydeoindole |
| Alternate Name(s) |
(3aR,7S,7aS)-7-Iodo-3-phenyl-octahydro-indole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18IN |
| InChI |
InChI=1S/C14H18IN/c15-13-8-4-7-11-12(9-16-14(11)13)10-5-2-1-3-6-10/h1-3,5-6,11-14,16H,4,7-9H2/t11-,12?,13+,14+/m1/s1 |
| InChIKey |
YYEJPGJYVFHYPM-KRCVMZOZSA-N |
| Molecular Weight |
327.209 g/mol |
| SMILES |
N1CC([C@@]2([C@]1([C@](CCC2)(I)[H])[H])[H])c1ccccc1 |
| SPLASH |
splash10-01ox-0090000000-8fed22dcd6c463e0df35 |
| Source of Spectrum |
PS-50-1293-35 |
| Wiley ID |
1325383 |
