| SpectraBase Spectrum ID |
HNrJon4tNWO |
| Name |
Benzyl (1R,2R)-2-(4-methoxyphenyl)-1-propionylcyclopropane-1-carboxylate |
| Appearance |
Pale yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.151809184 u |
| Formula |
C21H22O4 |
| InChI |
InChI=1S/C21H22O4/c1-3-19(22)21(20(23)25-14-15-7-5-4-6-8-15)13-18(21)16-9-11-17(24-2)12-10-16/h4-12,18H,3,13-14H2,1-2H3/t18-,21-/m1/s1 |
| InChIKey |
WPQQUPZOGJYFHX-WIYYLYMNSA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804614 |
| Molecular Weight |
338.403 g/mol |
| Quality |
98 |
| Reported Formula |
C21H22O4 |
| SMILES |
C1=CC(=CC=C1OC)[C@@]1([C@@](C1)(C(=O)OCC1=CC=CC=C1)C(CC)=O)[H] |
| SPLASH |
splash10-0006-9010000000-0d17e844247fe91499bf |
| Sample Comments |
dr = 5:1 |
| Source of Spectrum |
ACI-57-SM16-1l (DOI: 10.1002/anie.201804614) |
| Thin-Layer Chromatography |
0.50 (petroleum ether/EtOAc, 8:2) |
| Wiley ID |
1893029 |
