| SpectraBase Spectrum ID |
Fg47QAV5jEm |
| Name |
3-(1-adamantylthiocarbamoylamino)thiophene-2-carboxylic acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22N2O2S2 |
| InChI |
InChI=1S/C17H22N2O2S2/c1-21-15(20)14-13(2-3-23-14)18-16(22)19-17-7-10-4-11(8-17)6-12(5-10)9-17/h2-3,10-12H,4-9H2,1H3,(H2,18,19,22) |
| InChIKey |
IDXHVRFBRDVFLI-UHFFFAOYSA-N |
| Molecular Weight |
350.495 g/mol |
| SMILES |
N(C(NC12CC3CC(C2)CC(C1)C3)=S)c1c(C(=O)OC)scc1 |
| SPLASH |
splash10-0a4i-0902000000-0928e64f6b73e13d4b1d |
| Source of Spectrum |
Y-32-71-9 |
| Synonyms |
3-[[(1-adamantylamino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester
methyl 3-(1-adamantylcarbamothioylamino)thiophene-2-carboxylate |
| Wiley ID |
1341810 |
