SpectraBase Compound ID | 2srZ5kA2mhM |
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InChI | InChI=1S/C12H16O2/c13-9-5-2-6-10-14-11-12-7-3-1-4-8-12/h1,3-4,7-9H,2,5-6,10-11H2/i7+1 |
InChIKey | KDNUJAZVJXKPNI-CDYZYAPPSA-N |
Mol Weight | 193.25 g/mol |
Molecular Formula | C1113CH16O2 |
Exact Mass | 193.118385 g/mol |
SpectraBase Spectrum ID | 6YqpyYQX9fY |
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Name | 5-Benzyloxy-2-[13C]-pentanal |
Comments | Original formula: C11[13C]H16O2 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H16O2 |
InChI | InChI=1S/C12H16O2/c13-9-5-2-6-10-14-11-12-7-3-1-4-8-12/h1,3-4,7-9H,2,5-6,10-11H2/i7+1 |
InChIKey | KDNUJAZVJXKPNI-CDYZYAPPSA-N |
Molecular Weight | 193.250 g/mol |
SMILES | [13cH]1ccccc1COCCCCC=O |
SPLASH | splash10-0006-9300000000-193f2e2f596c5fe2a3c8 |
Source of Spectrum | F-38-1655-0 |
Wiley ID | 1188854 |