| SpectraBase Compound ID | 5GoM1vrubCH |
|---|---|
| InChI | InChI=1S/C9H9NO4/c1-2-14-9(11)7-3-5-8(6-4-7)10(12)13/h3-6H,2H2,1H3 |
| InChIKey | PHWSCBWNPZDYRI-UHFFFAOYSA-N |
| Mol Weight | 195.17 g/mol |
| Molecular Formula | C9H9NO4 |
| Exact Mass | 195.053158 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KHOYhC0R449 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H8NO4D |
| InChI | InChI=1S/C9H9NO4/c1-2-14-9(11)7-3-5-8(6-4-7)10(12)13/h3-6H,2H2,1H3 |
| InChIKey | PHWSCBWNPZDYRI-UHFFFAOYSA-N |
| Molecular Weight | 195.0529 |
| SMILES | c1(C(OCC)=O)ccc(N(=O)=O)cc1 |
| SPLASH | splash10-0udi-5900000000-be7c382ecaae401adaa9 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |