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2-(4-IODOPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBONITRILE

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2-(4-IODOPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBONITRILE
SpectraBase Compound ID LwVuhx6Bi9V
InChI InChI=1S/C16H13IN2/c17-13-5-7-14(8-6-13)19-10-9-12-3-1-2-4-15(12)16(19)11-18/h1-8,16H,9-10H2
InChIKey WITCCGWOPRMHMX-UHFFFAOYSA-N
Mol Weight 360.2 g/mol
Molecular Formula C16H13IN2
Exact Mass 360.012343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DWxtpvipeQP
Name 2-(4-IODOPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBONITRILE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13IN2
InChI InChI=1S/C16H13IN2/c17-13-5-7-14(8-6-13)19-10-9-12-3-1-2-4-15(12)16(19)11-18/h1-8,16H,9-10H2
InChIKey WITCCGWOPRMHMX-UHFFFAOYSA-N
Literature Reference Author R.YANG,Q.RUAN,B.Y.ZHANG,Z.L.ZHENG,F.MIAO,L.ZHOU,H.L.GENG
Literature Reference Citation MOLECULES,19,8051(2014)
Literature Reference DOI 10.3390/molecules19068051
Molecular Weight 360.197 g/mol
Solvent CDCl3
Source File Reference UWIR14784