| SpectraBase Spectrum ID |
InCOrQtCSOA |
| Name |
Cyclododecanecarboxylic acid, 5-nitro-2,12-dioxo-, phenylmethyl ester |
| Alternate Name(s) |
Benzyl 5-nitro-2,12-dioxocyclododecane-1-carboxylate
benzyl 5-nitro-2,12-dioxocyclododecanecarboxylate |
| CAS Registry Number |
86572-46-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25NO6 |
| InChI |
InChI=1S/C20H25NO6/c22-17-11-7-2-1-6-10-16(21(25)26)12-13-18(23)19(17)20(24)27-14-15-8-4-3-5-9-15/h3-5,8-9,16,19H,1-2,6-7,10-14H2 |
| InChIKey |
JKXGFOMMJWHGHB-UHFFFAOYSA-N |
| Molecular Weight |
375.421 g/mol |
| SMILES |
C1(N(=O)=O)CCC(C(C(OCc2ccccc2)=O)C(=O)CCCCCC1)=O |
| SPLASH |
splash10-006x-9100000000-88a68d0c8045fa11d541 |
| Source of Spectrum |
H-66-858-0 |
| Wiley ID |
1357170 |
