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Methyl 3-chloro-2-cyanobicyclo[3.2.1]oct-3-ene-6-carboxylate
SpectraBase Compound ID CahQlyXm79p
InChI InChI=1S/C11H12ClNO2/c1-15-11(14)8-3-6-2-7(8)4-10(12)9(6)5-13/h4,6-9H,2-3H2,1H3/t6-,7-,8+,9-/m1/s1
InChIKey PINKOQDXFXGVNY-LURQLKTLSA-N
Mol Weight 225.67 g/mol
Molecular Formula C11H12ClNO2
Exact Mass 225.055656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFvelKQJfmb
Name Methyl 3-chloro-2-cyanobicyclo[3.2.1]oct-3-ene-6-carboxylate
Alternate Name(s) 3-Chloro-2-cyano-6-bicyclo[3.2.1]oct-3-enecarboxylic acid methyl ester 3-Chloro-2-cyanobicyclo[3.2.1]oct-3-ene-6-carboxylic acid, methyl ester Methyl 3-chloranyl-2-cyano-bicyclo[3.2.1]oct-3-ene-6-carboxylate Methyl 3-chloro-2-cyano-bicyclo[3.2.1]oct-3-ene-6-carboxylate
CAS Registry Number 102861-26-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12ClNO2
InChI InChI=1S/C11H12ClNO2/c1-15-11(14)8-3-6-2-7(8)4-10(12)9(6)5-13/h4,6-9H,2-3H2,1H3/t6-,7-,8+,9-/m1/s1
InChIKey PINKOQDXFXGVNY-LURQLKTLSA-N
Molecular Weight 225.675 g/mol
SMILES C1(Cl)=C[C@]2(C[C@@]([C@]1(C#N)[H])(C[C@@]2(C(=O)OC)[H])[H])[H]
SPLASH splash10-000i-9200000000-06b2f56d72c9f5051a64
Wiley ID 1483253