| SpectraBase Spectrum ID |
JgnnOmxhsu4 |
| Name |
Z-(2S,5R)-1-(2-phenol-1-hydroxyethan-1yl)-5-ethyl-2-heptyl-pyrrolidine |
| Alternate Name(s) |
1-[(2S,5R)-2-ethyl-5-heptylpyrrolidinyl]-2-phenylethanol |
| CAS Registry Number |
120054-51-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H35NO |
| InChI |
InChI=1S/C21H35NO/c1-3-5-6-7-11-14-20-16-15-19(4-2)22(20)21(23)17-18-12-9-8-10-13-18/h8-10,12-13,19-21,23H,3-7,11,14-17H2,1-2H3/t19-,20+,21?/m0/s1 |
| InChIKey |
SIINVWHEFNVPGV-MCOCGALXSA-N |
| Molecular Weight |
317.517 g/mol |
| SMILES |
OC(N1[C@](CC[C@]1(CCCCCCC)[H])(CC)[H])Cc1ccccc1 |
| SPLASH |
splash10-000j-0890000000-f9c37d0489866b40ec47 |
| Source of Spectrum |
F-44-2467-8 |
| Wiley ID |
1317895 |
