| SpectraBase Spectrum ID |
9Fkd1a5BID3 |
| Name |
(.+/-.)-cis-Isofentanyl |
| Catalog Number |
24102 |
| CAS Registry Number |
79278-68-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O |
| InChI |
InChI=1S/C22H28N2O/c1-3-22(25)24(20-12-8-5-9-13-20)21-14-15-23(16-18(21)2)17-19-10-6-4-7-11-19/h4-13,18,21H,3,14-17H2,1-2H3/t18-,21+/m0/s1 |
| InChIKey |
MSAFCEWTMBDBFQ-GHTZIAJQSA-N |
| Molecular Weight |
336.479 g/mol |
| SMILES |
C(C(N([C@@]1(CCN(C[C@@]1(C)[H])Cc1ccccc1)[H])c1ccccc1)=O)C |
| SPLASH |
splash10-0007-9400000000-c85d4537cb121f433e65 |
| Source of Spectrum |
CAY-2023-593-0 |
| Wiley ID |
1888553 |
