| SpectraBase Spectrum ID |
FYbMOpx717B |
| Name |
Cyclopentanecarbonitrile, 2-butyl-1-phenyl-, cis- |
| Alternate Name(s) |
(1R,2R)-2-sec-butyl-1-phenylcyclopentanecarbonitrile
cis 2-butyl 1-phenyl 1-cyclopentanecarbonitrile |
| CAS Registry Number |
121926-34-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21N |
| InChI |
InChI=1S/C16H21N/c1-3-13(2)15-10-7-11-16(15,12-17)14-8-5-4-6-9-14/h4-6,8-9,13,15H,3,7,10-11H2,1-2H3/t13?,15-,16+/m1/s1 |
| InChIKey |
QBBAVHDBUSLBEO-CZVYVAOFSA-N |
| Molecular Weight |
227.351 g/mol |
| SMILES |
[C@@]1(C#N)([C@@](C(CC)C)(CCC1)[H])c1ccccc1 |
| SPLASH |
splash10-004i-0920000000-86ae814b1c215043b91e |
| Source of Spectrum |
I-67-563-73 |
| Wiley ID |
1228917 |
