| SpectraBase Compound ID | 3Ej9bIaRndC |
|---|---|
| InChI | InChI=1S/C12H13NO3/c1-2-3-9-16-12(10-13(14)15)11-7-5-4-6-8-11/h1,4-8,12H,3,9-10H2 |
| InChIKey | IJLQFLXCXMGMLC-UHFFFAOYSA-N |
| Mol Weight | 219.24 g/mol |
| Molecular Formula | C12H13NO3 |
| Exact Mass | 219.089543 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EAjym2cOj70 |
|---|---|
| Name | (1-but-3-ynoxy-2-nitro-ethyl)benzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO3 |
| InChI | InChI=1S/C12H13NO3/c1-2-3-9-16-12(10-13(14)15)11-7-5-4-6-8-11/h1,4-8,12H,3,9-10H2 |
| InChIKey | IJLQFLXCXMGMLC-UHFFFAOYSA-N |
| Molecular Weight | 219.240 g/mol |
| SMILES | C(N(=O)=O)C(c1ccccc1)OCCC#C |
| SPLASH | splash10-0udj-2900000000-8c04cb077a691346f787 |
| Source of Spectrum | SK-28-3531-3 |
| Wiley ID | 880151 |