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endo 1-methyl 2-ethoxycarbonyl-3(Z)-ethylidene-7-oxabicyclo[2.2.1]hept-5-ene
SpectraBase Compound ID 7UVYkcDFQA0
InChI InChI=1S/C12H16O3/c1-4-8-9-6-7-12(3,15-9)10(8)11(13)14-5-2/h4,6-7,9-10H,5H2,1-3H3/b8-4+/t9-,10-,12+/m0/s1
InChIKey BNQUEVKQIGQBFA-UERITUTLSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33vMvZadMV2
Name endo 1-methyl 2-ethoxycarbonyl-3(Z)-ethylidene-7-oxabicyclo[2.2.1]hept-5-ene
CAS Registry Number 130930-50-6
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-4-8-9-6-7-12(3,15-9)10(8)11(13)14-5-2/h4,6-7,9-10H,5H2,1-3H3/b8-4+/t9-,10-,12+/m0/s1
InChIKey BNQUEVKQIGQBFA-UERITUTLSA-N
Molecular Weight 208.257 g/mol
SMILES [C@@]12([C@@](\C(=C\C)[C@@](O2)(C=C1)[H])(C(=O)OCC)[H])C
SPLASH splash10-004i-9000000000-67eacedb05142070762e
Source of Spectrum KC-1990-2191-5
Synonyms ethyl (3Z)-3-ethylidene-1-methyl-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylate
Wiley ID 1206931