SpectraBase Compound ID | 9GpRpsVuLDx |
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InChI | InChI=1S/C12H16O2/c1-9(2)8-14-12(13)11-7-5-4-6-10(11)3/h4-7,9H,8H2,1-3H3 |
InChIKey | WBNOXPDHXZDLCY-UHFFFAOYSA-N |
Mol Weight | 192.26 g/mol |
Molecular Formula | C12H16O2 |
Exact Mass | 192.11503 g/mol |
SpectraBase Spectrum ID | 8aPAVTWauu4 |
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Name | Isobutyl ortho toluate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H16O2 |
InChI | InChI=1S/C12H16O2/c1-9(2)8-14-12(13)11-7-5-4-6-10(11)3/h4-7,9H,8H2,1-3H3 |
InChIKey | WBNOXPDHXZDLCY-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 192.258 g/mol |
SMILES | CC(C)COC(=O)c1ccccc1C |
SPLASH | splash10-014i-8900000000-4d3f2148398a336f3019 |
Source of Spectrum | SRH-2022-55-0 |
Synonyms | ortho-Toluic acid isobutyl ester |
Wiley ID | 1822598 |