| SpectraBase Spectrum ID |
9fImoV8o7nS |
| Name |
o{4'-[3'',4''-(methylenedioxy)benzylcarbonyl]-3'-hydroxyphenyl}-dimethyl-thiocarbamate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.082743820 u |
| Formula |
C18H17NO5S |
| InChI |
InChI=1S/C18H17NO5S/c1-19(2)18(25)24-12-4-5-13(15(21)9-12)14(20)7-11-3-6-16-17(8-11)23-10-22-16/h3-6,8-9,21H,7,10H2,1-2H3 |
| InChIKey |
KGSJSTUFDHPVBW-UHFFFAOYSA-N |
| Molecular Weight |
359.396 g/mol |
| SMILES |
C(OC=1C=C(O)C(=CC1)C(CC=1C=C2OCOC2=CC1)=O)(=S)N(C)C |
![O{4'-[3'',4''-(Methylenedioxy)benzylcarbonyl]-3'-hydroxyphenyl}-dimethyl-thiocarbamate](/api/spectrum/9fImoV8o7nS/structure.png?h=300&w=458 "O{4'-[3'',4''-(Methylenedioxy)benzylcarbonyl]-3'-hydroxyphenyl}-dimethyl-thiocarbamate")
