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2-Quinolinemethanol, 3-(acetyloxy)-1,2,3,4-tetrahydro-1-methyl-4-(methylphenylamino)-, acetate (ester), (2.alpha.,3.alpha.,4.beta.)-

View entire compound with spectra: 1 MS (GC)

2-Quinolinemethanol, 3-(acetyloxy)-1,2,3,4-tetrahydro-1-methyl-4-(methylphenylamino)-, acetate (ester), (2.alpha.,3.alpha.,4.beta.)-
SpectraBase Compound ID 14VK3gzJuP2
InChI InChI=1S/C22H26N2O4/c1-15(25)27-14-20-22(28-16(2)26)21(23(3)17-10-6-5-7-11-17)18-12-8-9-13-19(18)24(20)4/h5-13,20-22H,14H2,1-4H3/t20-,21+,22+/m1/s1
InChIKey URXURKCPNOKTJZ-FSSWDIPSSA-N
Mol Weight 382.46 g/mol
Molecular Formula C22H26N2O4
Exact Mass 382.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4k3JwUIGd16
Name 2-Quinolinemethanol, 3-(acetyloxy)-1,2,3,4-tetrahydro-1-methyl-4-(methylphenylamino)-, acetate (ester), (2.alpha.,3.alpha.,4.beta.)-
CAS Registry Number 107366-67-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O4
InChI InChI=1S/C22H26N2O4/c1-15(25)27-14-20-22(28-16(2)26)21(23(3)17-10-6-5-7-11-17)18-12-8-9-13-19(18)24(20)4/h5-13,20-22H,14H2,1-4H3/t20-,21+,22+/m1/s1
InChIKey URXURKCPNOKTJZ-FSSWDIPSSA-N
Molecular Weight 382.460 g/mol
SMILES [C@]1(N(c2c([C@@]([C@]1(OC(=O)C)[H])(N(c1ccccc1)C)[H])cccc2)C)(COC(=O)C)[H]
SPLASH splash10-03di-0971000000-c71630c2b5e236de06b3
Source of Spectrum KC-1986-1154-7
Synonyms 3.alpha.acetoxy-2.alpha.-acetoxymethyl-1-methyl-4.beta.-(N-methylanilino -1,2,3,4-tetrahydroquinoline 3.alpha.Acetoxy-2.alpha.-acetoxymethyl-1-methyl-4.beta.-(N-methylanilino-1,2,3,4-tetrahydroquinoline [(2R,3R,4S)-3-(acetyloxy)-1-methyl-4-(methylanilino)-1,2,3,4-tetrahydro-2-quinolinyl]methyl acetate
Wiley ID 1360661