| SpectraBase Spectrum ID |
2VggJB3nZr1 |
| Name |
1-Propanol, 2,2-dimethyl-, 4-nitrobenzoate |
| Alternate Name(s) |
1-Propanol, 2,2-dimethyl-, p-nitrobenzoate
Neopentyl 4-nitrobenzoate
2,2-Dimethylpropyl 4-nitrobenzoate
4-Nitrobenzoic acid 2,2-dimethylpropyl ester
4-Nitrobenzoic acid neopentyl ester |
| CAS Registry Number |
3581-73-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO4 |
| InChI |
InChI=1S/C12H15NO4/c1-12(2,3)8-17-11(14)9-4-6-10(7-5-9)13(15)16/h4-7H,8H2,1-3H3 |
| InChIKey |
OKBJGMCNFJRTJG-UHFFFAOYSA-N |
| Molecular Weight |
237.255 g/mol |
| SMILES |
CC(C)(C)COC(c1ccc(cc1)N(=O)=O)=O |
| SPLASH |
splash10-0pb9-9300000000-180b6b04a9fd44997ce0 |
| Source of Spectrum |
AD-0-4786-0 |
| Wiley ID |
1239425 |
