| SpectraBase Compound ID | 8ouNdPmvzby |
|---|---|
| InChI | InChI=1S/C6H9NO5/c1-11-5(4-7(9)10)3-6(8)12-2/h4H,3H2,1-2H3/b5-4- |
| InChIKey | FUOFYMSZCQEIQN-PLNGDYQASA-N |
| Mol Weight | 175.14 g/mol |
| Molecular Formula | C6H9NO5 |
| Exact Mass | 175.048072 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3ni0dAKosgs |
|---|---|
| Name | 3-BUTENOIC ACID, 3-METHOXY-4-NITRO-, METHYL ESTER, (E)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H9NO5 |
| InChI | InChI=1S/C6H9NO5/c1-11-5(4-7(9)10)3-6(8)12-2/h4H,3H2,1-2H3/b5-4- |
| InChIKey | FUOFYMSZCQEIQN-PLNGDYQASA-N |
| Molecular Weight | 175.0478 |
| SMILES | C(\C(=C\N(=O)=O)OC)C(OC)=O |
| SPLASH | splash10-102c-9600000000-1c64eb1a83d02eecf694 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |