| SpectraBase Spectrum ID |
BG6i962vYh4 |
| Name |
Benzoic acid, 4-(21-cyanoheneicosyl)-, methyl ester |
| Alternate Name(s) |
Methyl 4-(21-cyanohenicosyl)benzoate |
| CAS Registry Number |
134171-67-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H49NO2 |
| InChI |
InChI=1S/C30H49NO2/c1-33-30(32)29-25-23-28(24-26-29)22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-27-31/h23-26H,2-22H2,1H3 |
| InChIKey |
SEXAFHBKUCZLHH-UHFFFAOYSA-N |
| Molecular Weight |
455.727 g/mol |
| SMILES |
C(#N)CCCCCCCCCCCCCCCCCCCCCc1ccc(C(=O)OC)cc1 |
| SPLASH |
splash10-00di-0200900000-8b6b511db3670ae1da86 |
| Source of Spectrum |
F-47-1466-15 |
| Wiley ID |
1389089 |
