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(2R,6S,2'R,2''R)-N-Methyl-2-(2'-hydroxybutyl)-6-(2"-hydroxypentyl)-1,2,5,6-tetrahydropyridine
SpectraBase Compound ID IS4mLIKiekc
InChI InChI=1S/C15H29NO2/c1-4-7-15(18)11-13-9-6-8-12(16(13)3)10-14(17)5-2/h6,8,12-15,17-18H,4-5,7,9-11H2,1-3H3/t12-,13-,14+,15+/m0/s1
InChIKey VTAUDMKQDLSFJI-BYNSBNAKSA-N
Mol Weight 255.4 g/mol
Molecular Formula C15H29NO2
Exact Mass 255.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6dRwXua97O
Name (2R,6S,2'R,2''R)-N-Methyl-2-(2'-hydroxybutyl)-6-(2"-hydroxypentyl)-1,2,5,6-tetrahydropyridine
Alternate Name(s) (2R)-1-{(2S,6R)-6-[(2R)-2-hydroxybutyl]-1-methyl-1,2,3,6-tetrahydro-2-pyridinyl}-2-pentanol Andrachcine N-Methyl-2-(2'-hydroxybutyl)-6-(2''-hydroxypentyl)-1,2,5,6-tetrahydropyridine (2R)-1-[(2S,6R)-6-[(2R)-2-hydroxybutyl]-1-methyl-3,6-dihydro-2H-pyridin-2-yl]-2-pentanol (2R)-1-[(2S,6R)-1-methyl-6-[(2R)-2-oxidanylbutyl]-3,6-dihydro-2H-pyridin-2-yl]pentan-2-ol
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Formula C15H29NO2
InChI InChI=1S/C15H29NO2/c1-4-7-15(18)11-13-9-6-8-12(16(13)3)10-14(17)5-2/h6,8,12-15,17-18H,4-5,7,9-11H2,1-3H3/t12-,13-,14+,15+/m0/s1
InChIKey VTAUDMKQDLSFJI-BYNSBNAKSA-N
Molecular Weight 255.402 g/mol
SMILES O[C@@](C[C@]1(N([C@](C[C@](O)(CCC)[H])(CC=C1)[H])C)[H])(CC)[H]
SPLASH splash10-001i-3910000000-c0153b6f8ed797356d93
Source of Spectrum G4-63-763-2
Wiley ID 1608415