| SpectraBase Spectrum ID |
KoZvS6I3Qz0 |
| Name |
3-(1,4-Dihydro-2-hydroxy-1,4-dioxonaphthalen-3-yl)-2,2-dimethylpropyl 2-Ethylbutanoate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O5 |
| InChI |
InChI=1S/C21H26O5/c1-5-13(6-2)20(25)26-12-21(3,4)11-16-17(22)14-9-7-8-10-15(14)18(23)19(16)24/h7-10,13,24H,5-6,11-12H2,1-4H3 |
| InChIKey |
IDOOHQMCKCFPKO-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(C(CC)CC)=O)(C)C |
| SPLASH |
splash10-006x-0690000000-1055e19ca3880f529139 |
| Source of Spectrum |
AF-53-SM4-24 |
| Wiley ID |
1846332 |
