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3-Prop-2-ynoxycarbonylbicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID GS8xPskDlvF
InChI InChI=1S/C12H12O4/c1-2-5-16-12(15)10-8-4-3-7(6-8)9(10)11(13)14/h1,3-4,7-10H,5-6H2,(H,13,14)/t7-,8+,9+,10+/m1/s1
InChIKey MVLXYYBXGPWHBX-KATARQTJSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwqmWNCldwY
Name 3-Prop-2-ynoxycarbonylbicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Alternate Name(s) 3-Propargyloxycarbonylbicyclo[2.2.1]hept-5-ene-2-carboxylic acid 3-[oxo(prop-2-ynoxy)methyl]-2-bicyclo[2.2.1]hept-5-enecarboxylic acid Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, monoprop-2-ynyl ester
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Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-2-5-16-12(15)10-8-4-3-7(6-8)9(10)11(13)14/h1,3-4,7-10H,5-6H2,(H,13,14)/t7-,8+,9+,10+/m1/s1
InChIKey MVLXYYBXGPWHBX-KATARQTJSA-N
Molecular Weight 220.224 g/mol
SMILES OC([C@]1([C@@]2(C=C[C@@](C2)([C@@]1(C(=O)OCC#C)[H])[H])[H])[H])=O
SPLASH splash10-014i-9100000000-7f806e0a225a88760162
Wiley ID 1440642