SpectraBase Compound ID | InVtBCcoAKo |
---|---|
InChI | InChI=1S/C11H13NO5/c1-16-11(13)3-2-8-17-10-6-4-9(5-7-10)12(14)15/h4-7H,2-3,8H2,1H3 |
InChIKey | MJMZBXYBWMBFNY-UHFFFAOYSA-N |
Mol Weight | 239.23 g/mol |
Molecular Formula | C11H13NO5 |
Exact Mass | 239.079373 g/mol |
SpectraBase Spectrum ID | JjVbRKx8yKC |
---|---|
Name | Methyl 4-(p-nitrophenoxy)butyrate |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 239.079372518 u |
Formula | C11H13NO5 |
InChI | InChI=1S/C11H13NO5/c1-16-11(13)3-2-8-17-10-6-4-9(5-7-10)12(14)15/h4-7H,2-3,8H2,1H3 |
InChIKey | MJMZBXYBWMBFNY-UHFFFAOYSA-N |
Molecular Weight | 239.227 g/mol |
SMILES | C1=C(C=CC(=C1)N(=O)=O)OCCCC(=O)OC |