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Cyclobuta[a]naphthalene-1,2-dione-1-13C, 8-methyl-
SpectraBase Compound ID FgnZIklWZY4
InChI InChI=1S/C13H8O2/c1-7-3-2-4-8-5-6-9-11(10(7)8)13(15)12(9)14/h2-6H,1H3/i13+1
InChIKey LLCMHPFCQUSMEU-KCKQSJSWSA-N
Mol Weight 197.2 g/mol
Molecular Formula C1213CH8O2
Exact Mass 197.055784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21kH7ejSi5L
Name Cyclobuta[a]naphthalene-1,2-dione-1-13C, 8-methyl-
CAS Registry Number 121643-62-7
Comments Original formula: C12[13C]H8O2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8O2
InChI InChI=1S/C13H8O2/c1-7-3-2-4-8-5-6-9-11(10(7)8)13(15)12(9)14/h2-6H,1H3/i13+1
InChIKey LLCMHPFCQUSMEU-KCKQSJSWSA-N
Molecular Weight 197.197 g/mol
SMILES c12[13C](C(c1ccc1cccc(c21)C)=O)=O
SPLASH splash10-000f-0900000000-06451af3deda443002d6
Source of Spectrum B-42-1444-13
Synonyms 8-Methyl-[1-(13)C]cyclobuta[a]naphthalene-1,2-dione
Wiley ID 1193827