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CIS-CYCLOBUTANE-1,2-DICARBOXYLIC-ANHYDRIDE;CIS-3-OXABICYCLO-[3.2.0]-HEPTANE-2,4-DIONE
SpectraBase Compound ID HS95cR92aRv
InChI InChI=1S/C6H6O3/c7-5-3-1-2-4(3)6(8)9-5/h3-4H,1-2H2
InChIKey NMNZZIMBGSGRPN-UHFFFAOYSA-N
Mol Weight 126.11 g/mol
Molecular Formula C6H6O3
Exact Mass 126.031694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XmI0pZnUTt
Name 1,2-Cyclobutanedicarboxylic anhydride
CAS Registry Number 4462-96-8
Comments Less than 3 mono-isotopic peaks
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Formula C6H6O3
InChI InChI=1S/C6H6O3/c7-5-3-1-2-4(3)6(8)9-5/h3-4H,1-2H2
InChIKey NMNZZIMBGSGRPN-UHFFFAOYSA-N
Molecular Weight 126.111 g/mol
SMILES C1(=O)C2C(CC2)C(O1)=O
SPLASH splash10-0udi-9000000000-8267774e35a379feff87
Source of Spectrum C-113-4617-0
Synonyms 3-Oxabicyclo[3.2.0]heptane-2,4-dione 1,2-Cyclobutanedicarboxylic anhydride, cis-, 3-Oxabicyclo[3.2.0]heptane-2,4-dione, cis- 3-oxabicyclo[3.2.0]heptane-2,4-quinone
Wiley ID 1129731