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7-Oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-(1-methylethylidene)-, ethyl ester, exo-
SpectraBase Compound ID Ky2TOmU3HXZ
InChI InChI=1S/C12H16O3/c1-4-14-12(13)11-9-6-5-8(15-9)10(11)7(2)3/h5-6,8-9,11H,4H2,1-3H3/t8-,9+,11?/m1/s1
InChIKey KZTATVSGJAXBTB-VFXVZZSQSA-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 AJFmB1bYSqH
Name 7-Oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-(1-methylethylidene)-, ethyl ester, exo-
CAS Registry Number 130836-87-2
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-4-14-12(13)11-9-6-5-8(15-9)10(11)7(2)3/h5-6,8-9,11H,4H2,1-3H3/t8-,9+,11?/m1/s1
InChIKey KZTATVSGJAXBTB-VFXVZZSQSA-N
Molecular Weight 208.257 g/mol
SMILES C1(C([C@@]2(O[C@]1(C=C2)[H])[H])=C(C)C)C(=O)OCC
SPLASH splash10-004i-9020000000-4b5169a44eb8a7d18ca8
Source of Spectrum KC-1990-2191-2
Synonyms 7-Oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-(1-methylethylidene)-, ethyl ester, endo- endo 2-ethoxycarbonyl-3-isopropylidene-7-oxabicyclo[2.2.1]hept-5-ene ethyl 3-(1-methylethylidene)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylate exo 2-ethoxycarbonyl-3-isopropylidene-7-oxabicyclo[2.2.1]hept-5-ene
Wiley ID 1206929