| SpectraBase Spectrum ID |
55FRPQu6cJv |
| Name |
3-(1,4-Dihydro-2-hydroxy-1,4-dioxonaphthalen-3-yl)-2,2-dimethylpropyl Hexanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O5 |
| InChI |
InChI=1S/C21H26O5/c1-4-5-6-11-17(22)26-13-21(2,3)12-16-18(23)14-9-7-8-10-15(14)19(24)20(16)25/h7-10,25H,4-6,11-13H2,1-3H3 |
| InChIKey |
JGDQKCFDDQUBDE-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(CCCCC)=O)(C)C |
| SPLASH |
splash10-0006-0290000000-cb8a4f85ebd6403ee4a9 |
| Source of Spectrum |
AF-53-SM6-29 |
| Wiley ID |
1846337 |
