| SpectraBase Compound ID | KfVVU1LFfbe |
|---|---|
| InChI | InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i8D |
| InChIKey | GKOTWEXRHKVLLK-BNEYPBHNSA-N |
| Mol Weight | 179.24 g/mol |
| Molecular Formula | C11H132DO2 |
| Exact Mass | 179.105656 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LCzTEizybjg |
|---|---|
| Name | 2-Propyl-2-D1 2-methylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H13DO2 |
| InChI | InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i8D |
| InChIKey | GKOTWEXRHKVLLK-BNEYPBHNSA-N |
| Molecular Weight | 179.237 g/mol |
| SMILES | C(c1c(C)cccc1)(OC(C)(C)[2D])=O |
| SPLASH | splash10-014r-0900000000-e956ccf7810d7c44d62e |
| Source of Spectrum | 0-16-126-2 |
| Wiley ID | 1174463 |