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2.beta.-[2(S*)-(3,4-Dimethoxyphenyl)-2-hydroxyethyl]pyrrolidine
SpectraBase Compound ID COMDmQrxWU9
InChI InChI=1S/C14H21NO3/c1-17-13-6-5-10(8-14(13)18-2)12(16)9-11-4-3-7-15-11/h5-6,8,11-12,15-16H,3-4,7,9H2,1-2H3/t11-,12+/m1/s1
InChIKey PDFWHAUJOVADSI-NEPJUHHUSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TigGukd1Y7
Name 2.beta.-[2(S*)-(3,4-Dimethoxyphenyl)-2-hydroxyethyl]pyrrolidine
Alternate Name(s) (1S)-1-(3,4-dimethoxyphenyl)-2-[(2R)-pyrrolidinyl]ethanol
CAS Registry Number 86980-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-17-13-6-5-10(8-14(13)18-2)12(16)9-11-4-3-7-15-11/h5-6,8,11-12,15-16H,3-4,7,9H2,1-2H3/t11-,12+/m1/s1
InChIKey PDFWHAUJOVADSI-NEPJUHHUSA-N
Molecular Weight 251.326 g/mol
SMILES N1CCC[C@@]1(C[C@@](c1cc(OC)c(cc1)OC)(O)[H])[H]
SPLASH splash10-0j5i-0940000000-c480780cd77347fb31e0
Source of Spectrum J-49-2417-0
Wiley ID 1254573