SpectraBase Compound ID | 843rhKICpnW |
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InChI | InChI=1S/C9H8O2/c1-6-7-4-2-3-5-8(7)9(10)11-6/h2-6H,1H3/i9+1 |
InChIKey | XJVDIMLQFRPIMP-QBZHADDCSA-N |
Mol Weight | 149.15 g/mol |
Molecular Formula | C813CH8O2 |
Exact Mass | 149.055784 g/mol |
SpectraBase Spectrum ID | AZfS3GVwcWa |
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Name | 3-Methyl[carbonyl-13C]phthalide |
Comments | Original formula: C8[13C]H8O2 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H8O2 |
InChI | InChI=1S/C9H8O2/c1-6-7-4-2-3-5-8(7)9(10)11-6/h2-6H,1H3/i9+1 |
InChIKey | XJVDIMLQFRPIMP-QBZHADDCSA-N |
Molecular Weight | 149.153 g/mol |
SMILES | C1(O[13C](c2c1cccc2)=O)C |
SPLASH | splash10-0a59-1900000000-0e6654fe8b64662a0def |
Source of Spectrum | C-113-8777-0 |
Wiley ID | 1145527 |