| SpectraBase Spectrum ID |
GEDN1fTPWVS |
| Name |
S-2-[N-(cyclohex-1'-enyl)propionamido]phenyl thiopropionate |
| Alternate Name(s) |
S-{2-[3-(1-cyclohexen-1-ylamino)-3-oxopropyl]phenyl} propanethioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H23NO2S |
| InChI |
InChI=1S/C18H23NO2S/c1-2-18(21)22-16-11-7-6-8-14(16)12-13-17(20)19-15-9-4-3-5-10-15/h6-9,11H,2-5,10,12-13H2,1H3,(H,19,20) |
| InChIKey |
LVEDACKPDRFSJG-UHFFFAOYSA-N |
| Molecular Weight |
317.447 g/mol |
| SMILES |
N(C(CCc1c(SC(=O)CC)cccc1)=O)C1=CCCCC1 |
| SPLASH |
splash10-0udi-0090000000-8d862d98f0bf02b6431f |
| Source of Spectrum |
KC-1991-1509-3 |
| Wiley ID |
1317698 |
![S-2-[N-(cyclohex-1'-enyl)propionamido]phenyl thiopropionate](/api/spectrum/GEDN1fTPWVS/structure.png?h=300&w=458 "S-2-[N-(cyclohex-1'-enyl)propionamido]phenyl thiopropionate")
