| SpectraBase Compound ID | GQdd2PtStGd |
|---|---|
| InChI | InChI=1S/C4H4ClNO3/c5-4(7)2-1-3(2)6(8)9/h2-3H,1H2/t2-,3-/m0/s1 |
| InChIKey | FBPDIDUAHPMWSA-HRFVKAFMSA-N |
| Mol Weight | 149.53 g/mol |
| Molecular Formula | C4H4ClNO3 |
| Exact Mass | 148.987971 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GgDVRmceYyz |
|---|---|
| Name | 2-Nitro-1-(chlorocarbonyl)cyclopropane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.987970690 u |
| Formula | C4H4ClNO3 |
| InChI | InChI=1S/C4H4ClNO3/c5-4(7)2-1-3(2)6(8)9/h2-3H,1H2/t2-,3-/m0/s1 |
| InChIKey | FBPDIDUAHPMWSA-HRFVKAFMSA-N |
| SMILES | [C@@]1([C@@](N(=O)=O)(C1)[H])(C(=O)Cl)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.864206 |