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3-OXO-1,2,3,4-TETRAHYDROQUINOLIZINIUM-BROMIDE

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3-OXO-1,2,3,4-TETRAHYDROQUINOLIZINIUM-BROMIDE
SpectraBase Compound ID Lk5CJ1XO24s
InChI InChI=1S/C9H10NO.BrH/c11-9-5-4-8-3-1-2-6-10(8)7-9;/h1-3,6H,4-5,7H2;1H/q+1;/p-1
InChIKey VHRDWCATSMBGBE-UHFFFAOYSA-M
Mol Weight 228.09 g/mol
Molecular Formula C9H10BrNO
Exact Mass 226.994577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fg6p5ffW3gM
Name 3-OXO-1,2,3,4-TETRAHYDROQUINOLIZINIUM-BROMIDE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10BrNO
InChI InChI=1S/C9H10NO.BrH/c11-9-5-4-8-3-1-2-6-10(8)7-9;/h1-3,6H,4-5,7H2;1H/q+1;/p-1
InChIKey VHRDWCATSMBGBE-UHFFFAOYSA-M
Literature Reference Author E.I.KOSTIK,A.ABIKO,A.OKU
Literature Reference Citation J.ORG.CHEM.,66,1638(2001)
Literature Reference DOI 10.1021/jo001162g
Molecular Weight 228.088 g/mol
Solvent DMSO-D6
Source File Reference UWMS25512