| SpectraBase Spectrum ID |
FrqbWUWduwe |
| Name |
1,2-Azulenedicarboxylic acid, 6-(1,1-dimethylethyl)-4,8-dimethyl-, dimethyl ester |
| Alternate Name(s) |
Dimethyl 6-(tert-butyl)-4,8-dimethylazulene-1,2-dicarboxylate
dimethyl 6-tert-butyl-4,8-dimethyl-1,2-azulenedicarboxylate |
| CAS Registry Number |
98506-46-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24O4 |
| InChI |
InChI=1S/C20H24O4/c1-11-8-13(20(3,4)5)9-12(2)16-14(11)10-15(18(21)23-6)17(16)19(22)24-7/h8-10H,1-7H3 |
| InChIKey |
YPXZMPQVRCWYPM-UHFFFAOYSA-N |
| Molecular Weight |
328.408 g/mol |
| SMILES |
c12c(cc(c2C(=O)OC)C(=O)OC)c(cc(cc1C)C(C)(C)C)C |
| SPLASH |
splash10-002b-0098000000-57f27a5cd9e66b6f9e7d |
| Source of Spectrum |
H-68-438-0 |
| Wiley ID |
1326505 |
