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3-Phenyl-3-(1-pyrrolidino)propane-1,2-diol

View entire compound with spectra: 1 MS (GC)

3-Phenyl-3-(1-pyrrolidino)propane-1,2-diol
SpectraBase Compound ID 8loDSaBogL7
InChI InChI=1S/C13H19NO2/c15-10-12(16)13(14-8-4-5-9-14)11-6-2-1-3-7-11/h1-3,6-7,12-13,15-16H,4-5,8-10H2/t12-,13+/m1/s1
InChIKey JWKQLPQDIVVKSJ-OLZOCXBDSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGWkssVeE35
Name 3-Phenyl-3-(1-pyrrolidino)propane-1,2-diol
Alternate Name(s) (2S,3S)-3-Phenyl-3-(1-pyrrolidino)propane-1,2-diol 3-phenyl-3-(1-pyrrolidinyl)-1,2-propanediol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c15-10-12(16)13(14-8-4-5-9-14)11-6-2-1-3-7-11/h1-3,6-7,12-13,15-16H,4-5,8-10H2/t12-,13+/m1/s1
InChIKey JWKQLPQDIVVKSJ-OLZOCXBDSA-N
Molecular Weight 221.300 g/mol
SMILES O[C@](CO)([C@@](N1CCCC1)(c1ccccc1)[H])[H]
SPLASH splash10-03di-0900000000-e97710555c855473fbe1
Source of Spectrum F-53-28-14
Wiley ID 799945