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4-Quinolineacetic acid, .alpha.-cyano-, ethyl ester
SpectraBase Compound ID 8AHle7vdJi0
InChI InChI=1S/C14H12N2O2/c1-2-18-13(17)14(9-15)12-8-7-10-5-3-4-6-11(10)16(12)14/h3-8,12H,2H2,1H3
InChIKey RRXMSWPVYWUIIR-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C14H12N2O2
Exact Mass 240.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUtocav1Y4b
Name 4-Quinolineacetic acid, .alpha.-cyano-, ethyl ester
Alternate Name(s) 2-(1-Ethoxycarbonyl-1-cyano)methylene-1,2-dihydroquinoline Ethyl 1-cyano-1,1a-dihydroazirino[1,2-a]quinoline-1-carboxylate
CAS Registry Number 69512-64-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2O2
InChI InChI=1S/C14H12N2O2/c1-2-18-13(17)14(9-15)12-8-7-10-5-3-4-6-11(10)16(12)14/h3-8,12H,2H2,1H3
InChIKey RRXMSWPVYWUIIR-UHFFFAOYSA-N
Molecular Weight 240.262 g/mol
SMILES C1(N2c3c(cccc3)C=CC12)(C(=O)OCC)C#N
SPLASH splash10-00kf-0950000000-500964eee00b6fd4a7f6
Source of Spectrum Y-24-1471-2
Wiley ID 1243037