SpectraBase Compound ID | 1mOT9cl0kuy |
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InChI | InChI=1S/C10H12O3/c1-7(11)9-5-4-8(12-2)6-10(9)13-3/h4-6H,1-3H3/i7+1 |
InChIKey | VQTDPCRSXHFMOL-CDYZYAPPSA-N |
Mol Weight | 181.2 g/mol |
Molecular Formula | C913CH12O3 |
Exact Mass | 181.081999 g/mol |
SpectraBase Spectrum ID | A9eEbmyYApM |
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Name | 2',4'-Dimethoxy[1-13C]acetophenone |
Comments | Original formula: C9[13C]H12O3 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C10H12O3 |
InChI | InChI=1S/C10H12O3/c1-7(11)9-5-4-8(12-2)6-10(9)13-3/h4-6H,1-3H3/i7+1 |
InChIKey | VQTDPCRSXHFMOL-CDYZYAPPSA-N |
Molecular Weight | 181.195 g/mol |
SMILES | c1([13C](=O)C)c(cc(cc1)OC)OC |
SPLASH | splash10-014i-0900000000-d9556efbc6d4602cdb04 |
Source of Spectrum | KC-60-1640-6 |
Wiley ID | 1583452 |