| SpectraBase Spectrum ID |
55takw4Kcy |
| Name |
4-Methylpentyl 4-nitrobenzoate |
| CAS Registry Number |
59302-13-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NO4 |
| InChI |
InChI=1S/C13H17NO4/c1-10(2)4-3-9-18-13(15)11-5-7-12(8-6-11)14(16)17/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey |
XVIIQKJLXBBPHA-UHFFFAOYSA-N |
| Molecular Weight |
251.282 g/mol |
| SMILES |
c1cc(C(OCCCC(C)C)=O)ccc1N(=O)=O |
| SPLASH |
splash10-0ue9-9600000000-f1b5b1ee3afae06436d2 |
| Source of Spectrum |
NP-7-1657-0 |
| Synonyms |
4-Nitrobenzoic acid, 4-methylpentyl ester
4-Nitrobenzoic acid 4-methylpentyl ester
isohexyl 4-nitrobenzoate |
| Wiley ID |
1106324 |
