| SpectraBase Spectrum ID |
53SwJTXunic |
| Name |
Adamantan-1-yl 3-butylthiophene-2-carboxylate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.165351249 u |
| Formula |
C19H26O2S |
| InChI |
InChI=1S/C19H26O2S/c1-2-3-4-16-5-6-22-17(16)18(20)21-19-10-13-7-14(11-19)9-15(8-13)12-19/h5-6,13-15H,2-4,7-12H2,1H3 |
| InChIKey |
NIIAPJBDSKSGDA-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201701691 |
| Molecular Weight |
318.475 g/mol |
| Quality |
68 |
| Reported Formula |
C19H26O2S |
| SMILES |
C12(CC3CC(CC(C2)C3)C1)OC(=O)C=1SC=CC1CCCC |
| SPLASH |
splash10-000i-1900000000-e14f5b4dd169c0f67dff |
| Source of Spectrum |
ACI-56-SM19-6j (DOI: 10.1002/anie.201701691) |
| Thin-Layer Chromatography |
0.29 (Hexane/EtOAc, 24:1) |
| Wiley ID |
1896011 |
