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(1S,2R,3R,4R)-3-carbomethoxybicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID 1q9BmFsCWO0
InChI InChI=1S/C10H12O4/c1-14-10(13)8-6-3-2-5(4-6)7(8)9(11)12/h2-3,5-8H,4H2,1H3,(H,11,12)/t5-,6+,7-,8-/m0/s1
InChIKey JYZKYCYHXBQTCY-YWIQKCBGSA-N
Mol Weight 196.2 g/mol
Molecular Formula C10H12O4
Exact Mass 196.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KU1eYPdjNF1
Name (1S,2R,3R,4R)-3-carbomethoxybicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Alternate Name(s) (1S,2R,3R,4R)-3-methoxycarbonyl-2-bicyclo[2.2.1]hept-5-enecarboxylic acid (1R,2S,3S,4S)-3-methoxycarbonyl-2-bicyclo[2.2.1]hept-5-enecarboxylic acid (1R,2S,3S,4S)-3-methoxycarbonylbicyclo[2.2.1]hept-5-ene-2-carboxylic acid
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Formula C10H12O4
InChI InChI=1S/C10H12O4/c1-14-10(13)8-6-3-2-5(4-6)7(8)9(11)12/h2-3,5-8H,4H2,1H3,(H,11,12)/t5-,6+,7-,8-/m0/s1
InChIKey JYZKYCYHXBQTCY-YWIQKCBGSA-N
Molecular Weight 196.202 g/mol
SMILES OC([C@@]1([C@]([C@@]2(C=C[C@]1(C2)[H])[H])(C(=O)OC)[H])[H])=O
SPLASH splash10-014i-9300000000-2afad7cb863293e4ef46
Source of Spectrum QC-4-675-13
Wiley ID 883189