| SpectraBase Compound ID | IvyrSamwTPy |
|---|---|
| InChI | InChI=1S/C5H9NO2/c1-4-5(2,3)6(7)8/h4H,1H2,2-3H3 |
| InChIKey | XKNWVDRBOMGBKV-UHFFFAOYSA-N |
| Mol Weight | 115.13 g/mol |
| Molecular Formula | C5H9NO2 |
| Exact Mass | 115.063329 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F3RBgh2zDEi |
|---|---|
| Name | 3-Methyl-3-nitro-1-butene |
| Alternate Name(s) | 3-Methyl-3-nitro-but-1-ene |
| CAS Registry Number | 1809-67-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H9NO2 |
| InChI | InChI=1S/C5H9NO2/c1-4-5(2,3)6(7)8/h4H,1H2,2-3H3 |
| InChIKey | XKNWVDRBOMGBKV-UHFFFAOYSA-N |
| Molecular Weight | 115.132 g/mol |
| SMILES | C=CC(N(=O)=O)(C)C |
| SPLASH | splash10-00kf-9000000000-6bac836a3a3177dd06b1 |
| Source of Spectrum | O-27-741-0 |
| Wiley ID | 1125048 |