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[3a,7a-13C2]-5-phenylisobenzofuran-1,3-dione
SpectraBase Compound ID DDWf7OeJ9QB
InChI InChI=1S/C14H8O3/c15-13-11-7-6-10(8-12(11)14(16)17-13)9-4-2-1-3-5-9/h1-8H/i11+1,12+1
InChIKey YTRAFABYXOZRDF-ALQHTKJJSA-N
Mol Weight 226.2 g/mol
Molecular Formula C1213C2H8O3
Exact Mass 226.054054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRjry1JGom5
Name [3a,7a-13C2]-5-phenylisobenzofuran-1,3-dione
Comments Original formula: C12[13C]2H8O3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8O3
InChI InChI=1S/C14H8O3/c15-13-11-7-6-10(8-12(11)14(16)17-13)9-4-2-1-3-5-9/h1-8H/i11+1,12+1
InChIKey YTRAFABYXOZRDF-ALQHTKJJSA-N
Molecular Weight 226.200 g/mol
SMILES C1([13c]2[13c](C(O1)=O)cc(cc2)-c1ccccc1)=O
SPLASH splash10-0ufr-4930000000-289d2e9ba366bee91f82
Source of Spectrum B-50-1180-19
Synonyms [3,4-13C2]-1,1'-Biphenyl-3,4-dicarboxylic acid-anhydride
Wiley ID 745482