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1-Piperidineethanol, 2-[2-(2-butyl-1,3-dioxolan-2-yl)ethyl]-.beta.-phenyl-, [1R-(R*,R*)]-
SpectraBase Compound ID 4k6yQEyCWpw
InChI InChI=1S/C22H35NO3/c1-2-3-13-22(25-16-17-26-22)14-12-20-11-7-8-15-23(20)21(18-24)19-9-5-4-6-10-19/h4-6,9-10,20-21,24H,2-3,7-8,11-18H2,1H3/t20-,21+/m1/s1
InChIKey CGSWHJVJZWCJNY-RTWAWAEBSA-N
Mol Weight 361.5 g/mol
Molecular Formula C22H35NO3
Exact Mass 361.261694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BpLwkLSzvYF
Name 1-Piperidineethanol, 2-[2-(2-butyl-1,3-dioxolan-2-yl)ethyl]-.beta.-phenyl-, [1R-(R*,R*)]-
Alternate Name(s) (2R)-2-{(2R)-2-[2-(2-butyl-1,3-dioxolan-2-yl)ethyl]piperidinyl}-2-phenylethanol
CAS Registry Number 94458-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H35NO3
InChI InChI=1S/C22H35NO3/c1-2-3-13-22(25-16-17-26-22)14-12-20-11-7-8-15-23(20)21(18-24)19-9-5-4-6-10-19/h4-6,9-10,20-21,24H,2-3,7-8,11-18H2,1H3/t20-,21+/m1/s1
InChIKey CGSWHJVJZWCJNY-RTWAWAEBSA-N
Molecular Weight 361.526 g/mol
SMILES OC[C@](N1[C@@](CCC2(OCCO2)CCCC)(CCCC1)[H])(c1ccccc1)[H]
SPLASH splash10-001i-0229000000-783f2f62d28168a62915
Source of Spectrum J-50-672-5
Wiley ID 1349101