| SpectraBase Spectrum ID |
LiNHZRxoYQ2 |
| Name |
methyl N-(4-methyl-5-acetyl-3-carboxyethyl-thiophene)dithiocarbamate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO3S3 |
| InChI |
InChI=1S/C12H15NO3S3/c1-6-8(4-5-9(15)16)11(13-12(17)18-3)19-10(6)7(2)14/h4-5H2,1-3H3,(H,13,17)(H,15,16) |
| InChIKey |
MIUSXQFBOPXKBB-UHFFFAOYSA-N |
| Molecular Weight |
317.436 g/mol |
| SMILES |
OC(CCc1c(c(sc1NC(=S)SC)C(=O)C)C)=O |
| SPLASH |
splash10-014i-0009000000-dad83e9365cdb99629a2 |
| Source of Spectrum |
F2-45-1490-4b |
| Wiley ID |
1703321 |
