SpectraBase Compound ID | Ep9TxkhrOWd |
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InChI | InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h5-6H,3-4H2,1-2H3/b6-5+/i7+1 |
InChIKey | GFUGBRNILVVWIE-CTPMBVFUSA-N |
Mol Weight | 129.16 g/mol |
Molecular Formula | C613CH12O2 |
Exact Mass | 129.087084 g/mol |
SpectraBase Spectrum ID | 3PZbYoVP6Ja |
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Name | Methyl 1-[13C]hex-2-enoate |
Comments | Original formula: C6[13C]H12O2 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H12O2 |
InChI | InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h5-6H,3-4H2,1-2H3/b6-5+/i7+1 |
InChIKey | GFUGBRNILVVWIE-CTPMBVFUSA-N |
Molecular Weight | 129.163 g/mol |
SMILES | C(\C=C\[13C](=O)OC)CC |
SPLASH | splash10-0btj-9300000000-f37f199e873082c11e1d |
Source of Spectrum | CRT-11-318-8 |
Wiley ID | 1715186 |