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1-Methyl-7-oxabicyclo[2.2.1]heptan-2-one
SpectraBase Compound ID IVQPnIiomAW
InChI InChI=1S/C7H10O2/c1-7-3-2-5(9-7)4-6(7)8/h5H,2-4H2,1H3/t5-,7+/m0/s1
InChIKey ZDMSAXHBQCYHAH-CAHLUQPWSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3j7nsA0pJXb
Name 1-Methyl-7-oxabicyclo[2.2.1]heptan-2-one
Alternate Name(s) (1R,4R)-1-methyl-7-oxabicyclo[2.2.1]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-7-3-2-5(9-7)4-6(7)8/h5H,2-4H2,1H3/t5-,7+/m0/s1
InChIKey ZDMSAXHBQCYHAH-CAHLUQPWSA-N
Literature Reference DOI 10.1002/cjoc.20030210736
Molecular Weight 126.155 g/mol
SMILES C1C[C@]2(O[C@@]1(CC2=O)[H])C
SPLASH splash10-0002-9000000000-0df0183291dcf52bf850
Source of Spectrum CJC-21-906-1
Wiley ID 1773819