| SpectraBase Compound ID | H44cPmnh8TI |
|---|---|
| InChI | InChI=1S/C12H13NO2/c1-10(14)15-12(2,9-13)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3/t12-/m0/s1 |
| InChIKey | WYLQNFDKKMXWNC-LBPRGKRZSA-N |
| Mol Weight | 203.24 g/mol |
| Molecular Formula | C12H13NO2 |
| Exact Mass | 203.094629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9FroIsT0Rr1 |
|---|---|
| Name | (S)-2-Acetoxy-2-methyl-3-phenylpropanenitrile |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO2 |
| InChI | InChI=1S/C12H13NO2/c1-10(14)15-12(2,9-13)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3/t12-/m0/s1 |
| InChIKey | WYLQNFDKKMXWNC-LBPRGKRZSA-N |
| Molecular Weight | 203.241 g/mol |
| SMILES | C(#N)[C@@](OC(=O)C)(Cc1ccccc1)C |
| SPLASH | splash10-0006-4910000000-06d575bbb7124856d3c3 |
| Source of Spectrum | QE-6-2568-((S)-3b) |
| Wiley ID | 844890 |