| SpectraBase Spectrum ID |
9pml0th5ZAk |
| Name |
Benzyl (1R,2R)-1-acetyl-2-(3-chloro-4-methoxyphenyl)cyclopropane-1-carboxylate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
358.097186788 u |
| Formula |
C20H19ClO4 |
| InChI |
InChI=1S/C20H19ClO4/c1-13(22)20(19(23)25-12-14-6-4-3-5-7-14)11-16(20)15-8-9-18(24-2)17(21)10-15/h3-10,16H,11-12H2,1-2H3/t16-,20+/m1/s1 |
| InChIKey |
PTBCVLRAPUHVTO-UZLBHIALSA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201804614 |
| Molecular Weight |
358.821 g/mol |
| Quality |
75 |
| Reported Formula |
C20H19O4Cl |
| SMILES |
C1(=CC(=CC=C1OC)[C@@]1([C@@](C1)(C(=O)OCC1=CC=CC=C1)C(C)=O)[H])Cl |
| SPLASH |
splash10-0006-9100000000-70a378bd2543c5f3cb6e |
| Sample Comments |
dr > 20:1 |
| Source of Spectrum |
ACI-57-SM18-1p (DOI: 10.1002/anie.201804614) |
| Thin-Layer Chromatography |
0.85 (dichloromethane) |
| Wiley ID |
1893033 |
