| SpectraBase Spectrum ID |
DWpjw6NGPXp |
| Name |
Benzyl (1R,2S)-1-acetyl-2-(thiophen-2-yl)cyclopropane-1-carboxylate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.082015546 u |
| Formula |
C17H16O3S |
| InChI |
InChI=1S/C17H16O3S/c1-12(18)17(10-14(17)15-8-5-9-21-15)16(19)20-11-13-6-3-2-4-7-13/h2-9,14H,10-11H2,1H3/t14-,17+/m1/s1 |
| InChIKey |
MJGJNRUVMKWSEH-PBHICJAKSA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804614 |
| Quality |
98 |
| Reported Formula |
C17H16O3S |
| SMILES |
C1([C@@]2([C@@](C2)(C(=O)OCC2=CC=CC=C2)C(C)=O)[H])=CC=CS1 |
| SPLASH |
splash10-0006-9000000000-127fd21dba0f2ee91b0f |
| Sample Comments |
dr > 20:1 |
| Source of Spectrum |
ACI-57-SM19-1r (DOI: 10.1002/anie.201804614) |
| Thin-Layer Chromatography |
0.40 (petroleum ether/EtOAc, 9:1) |
| Wiley ID |
1893035 |
