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3-Methyl[carbonyl-13C]phthalide
SpectraBase Compound ID 843rhKICpnW
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZfS3GVwcWa
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