| SpectraBase Spectrum ID |
BaMtwWgio40 |
| Name |
S-2-[N-(cyclohex-1'-enyl)propionamido]phenyl thiobutyrate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H25NO2S |
| InChI |
InChI=1S/C19H25NO2S/c1-2-8-19(22)23-17-12-7-6-9-15(17)13-14-18(21)20-16-10-4-3-5-11-16/h6-7,9-10,12H,2-5,8,11,13-14H2,1H3,(H,20,21) |
| InChIKey |
HMCATLOHICYZRZ-UHFFFAOYSA-N |
| Molecular Weight |
331.474 g/mol |
| SMILES |
N(C(CCc1c(SC(=O)CCC)cccc1)=O)C1=CCCCC1 |
| SPLASH |
splash10-0udi-0090000000-ac89b98c0c117d985d81 |
| Source of Spectrum |
KC-1991-1508-3 |
| Synonyms |
S-{2-[3-(1-cyclohexen-1-ylamino)-3-oxopropyl]phenyl} butanethioate |
| Wiley ID |
1328736 |
![S-2-[N-(cyclohex-1'-enyl)propionamido]phenyl thiobutyrate](/api/spectrum/BaMtwWgio40/structure.png?h=300&w=458 "S-2-[N-(cyclohex-1'-enyl)propionamido]phenyl thiobutyrate")
