| SpectraBase Compound ID | CS8FUPXtoLd |
|---|---|
| InChI | InChI=1S/C9H11NO2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2/i7+1 |
| InChIKey | ZROLMSLMPMSLRM-CDYZYAPPSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C813CH11NO2 |
| Exact Mass | 166.082333 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 42QjQPEBpHf |
|---|---|
| Name | 3-13C-3-phenyl-1-nitropropane |
| Comments | Original formula: C8[13C]H11NO2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H11NO2 |
| InChI | InChI=1S/C9H11NO2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2/i7+1 |
| InChIKey | ZROLMSLMPMSLRM-CDYZYAPPSA-N |
| Molecular Weight | 166.184 g/mol |
| SMILES | [13CH2](CCN(=O)=O)c1ccccc1 |
| SPLASH | splash10-052f-9500000000-536dfc3bc884f120d78a |
| Source of Spectrum | MR-3-32-12 |
| Wiley ID | 1161381 |