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7-Oxabicyclo[2.2.1]hept-5-en-2-<endo.-yl benzoate
SpectraBase Compound ID 6Nh8nK9IrJ4
InChI InChI=1S/C13H12O3/c14-13(9-4-2-1-3-5-9)16-12-8-10-6-7-11(12)15-10/h1-7,10-12H,8H2/t10-,11+,12-/m0/s1
InChIKey ITDVZKVLWURFTN-TUAOUCFPSA-N
Mol Weight 216.24 g/mol
Molecular Formula C13H12O3
Exact Mass 216.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFL6Lz36S4D
Name 7-Oxabicyclo[2.2.1]hept-5-en-2-
Alternate Name(s) 7-Oxabicyclo[2.2.1]hept-5-en-2-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O3
InChI InChI=1S/C13H12O3/c14-13(9-4-2-1-3-5-9)16-12-8-10-6-7-11(12)15-10/h1-7,10-12H,8H2/t10-,11+,12-/m0/s1
InChIKey ITDVZKVLWURFTN-TUAOUCFPSA-N
Molecular Weight 216.236 g/mol
SMILES C(O[C@@]1([C@@]2(O[C@](C1)(C=C2)[H])[H])[H])(=O)c1ccccc1
SPLASH splash10-0a4i-6900000000-810bc9785e3cc8aba93b
Source of Spectrum AC-1992-639-22
Wiley ID 811442