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7-Oxabicyclo[2.2.1]hept-5-en-2-one
SpectraBase Compound ID 31vDJCBt60J
InChI InChI=1S/C6H6O2/c7-5-3-4-1-2-6(5)8-4/h1-2,4,6H,3H2/t4-,6+/m1/s1
InChIKey UOJMBOVGSKPEHF-XINAWCOVSA-N
Mol Weight 110.11 g/mol
Molecular Formula C6H6O2
Exact Mass 110.036779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATlmE9ajOVK
Name 7-Oxabicyclo[2.2.1]hept-5-en-2-one
CAS Registry Number 95530-78-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6O2
InChI InChI=1S/C6H6O2/c7-5-3-4-1-2-6(5)8-4/h1-2,4,6H,3H2/t4-,6+/m1/s1
InChIKey UOJMBOVGSKPEHF-XINAWCOVSA-N
Molecular Weight 110.112 g/mol
SMILES C=1[C@@]2(O[C@@](CC2=O)(C1)[H])[H]
SPLASH splash10-014i-9000000000-e0fc4585ca4729597912
Source of Spectrum H-65-1703-0
Synonyms 7-Oxabicyclo[2.2.1]hept-2-en-5-one
Wiley ID 1122346