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(+/-)-METHYL-6-{1-[2-(INDOL-3-YL)-1-OXOETHYL]}-4-alpha-BROMO-6-AZABICYCLO-[3.2.1]-OCT-2-ENE-5-CARBOXYLATE
SpectraBase Compound ID AeqvuR3ndfm
InChI InChI=1S/C19H19BrN2O3/c1-25-18(24)19-9-12(6-7-16(19)20)11-22(19)17(23)8-13-10-21-15-5-3-2-4-14(13)15/h2-7,10,12,16,21H,8-9,11H2,1H3/t12-,16+,19-/m0/s1
InChIKey SJOVWPLEPUYTKQ-MOFZMDFASA-N
Mol Weight 403.28 g/mol
Molecular Formula C19H19BrN2O3
Exact Mass 402.057905 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJIsVXrUzMm
Name (+/-)-METHYL-6-{1-[2-(INDOL-3-YL)-1-OXOETHYL]}-4-alpha-BROMO-6-AZABICYCLO-[3.2.1]-OCT-2-ENE-5-CARBOXYLATE
Compound Number 16
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H19BrN2O3/c1-25-18(24)19-9-12(6-7-16(19)20)11-22(19)17(23)8-13-10-21-15-5-3-2-4-14(13)15/h2-7,10,12,16,21H,8-9,11H2,1H3/t12-,16+,19-/m0/s1
InChIKey SJOVWPLEPUYTKQ-MOFZMDFASA-N
Literature Reference E.GACS-BAITZ,H.BOELCSKEI,C.SZANTAY J.CHEM.SOC.PERKIN-2,213(1994)
Solvent Chloroform-d:Dimethyl sulfoxide-d6
Technique SELECTIVE DECOUPLING; APT, DEPT, INEPT; C/H SHIFT CORRELATION