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3-Pyridinemethanol, 1,2,3,6-tetrahydro-2,5-dimethyl-.alpha.-(2-methylpropyl)-2-[(5-methyl-2-pyridinyl)methyl]-6-phenyl-, acetate (ester), dihydrochloride, [2.alpha.,3.beta.(S*),6.alpha.]-
SpectraBase Compound ID BS9YParEk7e
InChI InChI=1S/C27H36N2O2/c1-18(2)14-25(31-21(5)30)24-15-20(4)26(22-10-8-7-9-11-22)29-27(24,6)16-23-13-12-19(3)17-28-23/h7-13,15,17-18,24-26,29H,14,16H2,1-6H3
InChIKey MVRLHLYXHSNIRW-UHFFFAOYSA-N
Mol Weight 420.6 g/mol
Molecular Formula C27H36N2O2
Exact Mass 420.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpB17ce2DNC
Name 3-Pyridinemethanol, 1,2,3,6-tetrahydro-2,5-dimethyl-.alpha.-(2-methylpropyl)-2-[(5-methyl-2-pyridinyl)methyl]-6-phenyl-, acetate (ester), dihydrochloride, [2.alpha.,3.beta.(S*),6.alpha.]-
CAS Registry Number 64880-61-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36N2O2
InChI InChI=1S/C27H36N2O2/c1-18(2)14-25(31-21(5)30)24-15-20(4)26(22-10-8-7-9-11-22)29-27(24,6)16-23-13-12-19(3)17-28-23/h7-13,15,17-18,24-26,29H,14,16H2,1-6H3
InChIKey MVRLHLYXHSNIRW-UHFFFAOYSA-N
Molecular Weight 420.597 g/mol
SMILES N1C(C(=CC(C1(Cc1ncc(cc1)C)C)C(OC(=O)C)CC(C)C)C)c1ccccc1
SPLASH splash10-0a4u-5930000000-124af7a1dcc1c8a74e9b
Source of Spectrum I-55-2675-0
Synonyms 1-{2,5-dimethyl-2-[(5-methyl-2-pyridinyl)methyl]-6-phenyl-1,2,3,6-tetrahydro-3-pyridinyl}-3-methylbutyl acetate 2,5-Dimethyl-2-(5'-methyl-2'picolyl)-3-(1''-acetoxy-3''-methylbutyl)-6-phenyl-4,5-didehydropiperidine 2,5-Dimethyl-2-(5'-methyl-2'picolyl)-3-(1''-acetoxy-3''-methylbutyl)-6-phenyl-4,5-didehydropiperidine dihydrochloride 3-Pyridinemethanol, 1,2,3,6-tetrahydro-2,5-dimethyl-.alpha.-(2-methylpropyl)-2-[(5-methyl-2-pyridinyl)methyl]-6-phenyl-, acetate (ester),
Wiley ID 1378130