SpectraBase Compound ID | 9UBJJ93coBV |
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InChI | InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i1D3,2D3 |
InChIKey | GKOTWEXRHKVLLK-WFGJKAKNSA-N |
Mol Weight | 184.27 g/mol |
Molecular Formula | C11H82D6O2 |
Exact Mass | 184.13704 g/mol |
SpectraBase Spectrum ID | H0GsJmVweco |
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Name | 2-Propyl-1,1,1,3,3,3-D6 2-methylbenzoate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H8D6O2 |
InChI | InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i1D3,2D3 |
InChIKey | GKOTWEXRHKVLLK-WFGJKAKNSA-N |
Molecular Weight | 184.268 g/mol |
SMILES | C(c1c(C)cccc1)(OC(C([2D])([2D])[2D])C([2D])([2D])[2D])=O |
SPLASH | splash10-014r-0900000000-1308555a60a9887782c5 |
Source of Spectrum | 0-16-126-2 |
Wiley ID | 1174471 |