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13-IODO-8-AZA-TRICYCLO-[7.3.1.0(2,7)]-TRIDECA-2,4,6-TRIENE
SpectraBase Compound ID 15GWPnxGSQs
InChI InChI=1S/C12H14IN/c13-12-9-5-3-7-11(12)14-10-6-2-1-4-8(9)10/h1-2,4,6,9,11-12,14H,3,5,7H2/t9?,11-,12?/m1/s1
InChIKey IJFYCPDZDPMNIT-CKBZRRDASA-N
Mol Weight 299.16 g/mol
Molecular Formula C12H14IN
Exact Mass 299.017094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5XaqPSooVxt
Name 13-IODO-8-AZA-TRICYCLO-[7.3.1.0(2,7)]-TRIDECA-2,4,6-TRIENE
Compound Number XI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14IN
InChI InChI=1S/C12H14IN/c13-12-9-5-3-7-11(12)14-10-6-2-1-4-8(9)10/h1-2,4,6,9,11-12,14H,3,5,7H2/t9?,11-,12?/m1/s1
InChIKey IJFYCPDZDPMNIT-CKBZRRDASA-N
Literature Reference Author R.R.GATAULLIN,F.F.MINNIGULOV,A.A.FATYKHOV,L.V.SPIRIKHIN,I.B. ABDRAKHMANOV
Literature Reference Citation RUSS.J.ORG.CHEM.,37,1289(2001)
Literature Reference DOI 10.1023/A:1013183605455
Molecular Weight 299.154 g/mol
Solvent CDCl3
Source File Reference UWVN5657