| SpectraBase Spectrum ID |
G2gH4VXOB9i |
| Name |
Cyclododecanebutanoic acid, 1-cyano-2-oxo-, methyl ester |
| Alternate Name(s) |
Methyl 4-(1-cyano-2-oxocyclododecyl)butanoate |
| CAS Registry Number |
104891-10-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H29NO3 |
| InChI |
InChI=1S/C18H29NO3/c1-22-17(21)12-10-14-18(15-19)13-9-7-5-3-2-4-6-8-11-16(18)20/h2-14H2,1H3 |
| InChIKey |
RURPEPMPFUUWMI-UHFFFAOYSA-N |
| Molecular Weight |
307.434 g/mol |
| SMILES |
C1(C#N)(C(=O)CCCCCCCCCC1)CCCC(=O)OC |
| SPLASH |
splash10-052g-9210000000-caa6828f7a82b5ff2729 |
| Source of Spectrum |
H-68-1995-8 |
| Wiley ID |
1309074 |
