| SpectraBase Spectrum ID |
GUcOoxPVCjq |
| Name |
3-(1,4-Dihydro-2-hydroxy-1,4-dioxonaphthalen-3-yl)-2,2-dimethylpropyl 3-Methylpentanoate |
| Appearance |
Yellow gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O5 |
| InChI |
InChI=1S/C21H26O5/c1-5-13(2)10-17(22)26-12-21(3,4)11-16-18(23)14-8-6-7-9-15(14)19(24)20(16)25/h6-9,13,25H,5,10-12H2,1-4H3 |
| InChIKey |
OZJGNSOEIWAMTM-UHFFFAOYSA-N |
| Instrument Name |
GCMS-QP-5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm901545z |
| Molecular Weight |
358.434 g/mol |
| SMILES |
OC1=C(C(c2ccccc2C1=O)=O)CC(COC(CC(CC)C)=O)(C)C |
| SPLASH |
splash10-0096-0890000000-e06c50cc6aebcc6d3482 |
| Source of Spectrum |
AF-53-SM6-28 |
| Wiley ID |
1846336 |
