- Formula: C12H13D11O2
- Molecular weight: 211.3855
- IUPAC Standard InChIKey: NCDCLPBOMHPFCV-WUVLYGMHSA-N
- Chemical structure:
This structure is also available as a 2d Mol file
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, polar column, custom temperature program
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|Column type||Active phase||I||Reference||Comment|
|Capillary||Carbowax||1600.||Rowan, Allen, et al., 1999||30. m/0.25 mm/0.25 «mu»m; Program: 40C (10min) => 3C/min => 100C => 5C/min => 220C|
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Rowan, Allen, et al., 1999
Rowan, D.D.; Allen, J.M.; Fielder, S.; Hunt, M.B., Biosynthesis of straight-chain ester volatiles in Red Delicious and Granny Smith apples using deuterium-labeled precursors, J. Agric. Food Chem., 1999, 47, 7, 2553-2562, https://doi.org/10.1021/jf9809028 . [all data]
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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