| SpectraBase Spectrum ID |
HO4yjHKX593 |
| Name |
(3R*,4R*)-Ethyl 3-benzyl-6-chloro-4-isopropyl-2-oxochroman-3-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.128486917 u |
| Formula |
C22H23ClO4 |
| GC Column |
HP1 (30 m x 0.32 mm, film thickness 0.25 micrometer) |
| InChI |
InChI=1S/C22H23ClO4/c1-4-26-20(24)22(13-15-8-6-5-7-9-15)19(14(2)3)17-12-16(23)10-11-18(17)27-21(22)25/h5-12,14,19H,4,13H2,1-3H3/t19-,22-/m1/s1 |
| InChIKey |
GKAKHJYWJGWERA-DENIHFKCSA-N |
| Instrument Name |
HP 5995C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.24820/ark.5550190.p011.877 |
| Molecular Weight |
386.875 g/mol |
| Quality |
106 |
| Reported Formula |
C22H23ClO4 |
| SMILES |
C1(Cl)=CC2=C(OC([C@]([C@@]2(C(C)C)[H])(C(=O)OCC)CC=2C=CC=CC2)=O)C=C1 |
| SPLASH |
splash10-000x-9870000000-2a7b29719dd859aaa78f |
| Sample Comments |
dr 89:11 |
| Source of Spectrum |
ARK-2023-59-8f (DOI: 10.24820/ark.5550190.p011.877) |
| Wiley ID |
1911241 |
