| SpectraBase Spectrum ID |
7NmSOJ5I1r1 |
| Name |
Pregn-5-ene-20-carbonitrile, 3-(1,1-dimethylethoxy)-, (3.beta.)- |
| Alternate Name(s) |
2-[(1S,2R,5S,10S,11S,14R,15S)-5-(tert-butoxy)-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl]propanenitrile
3.beta.-tert-butoxy-20-carbonitrilepregn-5-ene |
| CAS Registry Number |
62623-47-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H41NO |
| InChI |
InChI=1S/C26H41NO/c1-17(16-27)21-9-10-22-20-8-7-18-15-19(28-24(2,3)4)11-13-25(18,5)23(20)12-14-26(21,22)6/h7,17,19-23H,8-15H2,1-6H3/t17?,19-,20-,21+,22-,23-,25-,26+/m0/s1 |
| InChIKey |
RHVMEFGONUDGHE-KYHMCFAZSA-N |
| Molecular Weight |
383.620 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(C)(C)C)(C4)[H])C)[H])(CC[C@@]1(C(C#N)C)[H])[H])C |
| SPLASH |
splash10-0a4i-9232000000-2a4cc5f8ebe3ffce4f2a |
| Source of Spectrum |
C-99-1540-0 |
| Wiley ID |
1361195 |
