| SpectraBase Compound ID | LPO28mLu96N |
|---|---|
| InChI | InChI=1S/C3H6N2O6/c6-1-3(2-7,4(8)9)5(10)11/h6-7H,1-2H2/i1D2,2D2 |
| InChIKey | IUKKSAGYDLAHGF-LNLMKGTHSA-N |
| Mol Weight | 170.11 g/mol |
| Molecular Formula | C3H2D4N2O6 |
| Exact Mass | 170.047693 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KUgv0tdZEwK |
|---|---|
| Name | 2,2-Dinitropropane-1,3-diol-D4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C3H2D4N2O6 |
| InChI | InChI=1S/C3H6N2O6/c6-1-3(2-7,4(8)9)5(10)11/h6-7H,1-2H2/i1D2,2D2 |
| InChIKey | IUKKSAGYDLAHGF-LNLMKGTHSA-N |
| Molecular Weight | 170.113 g/mol |
| SMILES | OC(C(C(O)([D])[D])(N(=O)=O)N(=O)=O)([D])[D] |
| SPLASH | splash10-001i-9000000000-0b9cb5ebbed17d991505 |
| Source of Spectrum | H1-38-2001-5 |
| Wiley ID | 756454 |