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1-[(2R,3S)-2-(4-chlorophenyl)-1,3-dimethyl-3-pyrrolidinyl]ethanone
SpectraBase Compound ID 2cDWKcOj3cy
InChI InChI=1S/C14H18ClNO/c1-10(17)14(2)8-9-16(3)13(14)11-4-6-12(15)7-5-11/h4-7,13H,8-9H2,1-3H3/t13-,14-/m1/s1
InChIKey HIXWIHNDXSZPCI-ZIAGYGMSSA-N
Mol Weight 251.76 g/mol
Molecular Formula C14H18ClNO
Exact Mass 251.107692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIFJW4uL57n
Name 1-[(2R,3S)-2-(4-chlorophenyl)-1,3-dimethyl-3-pyrrolidinyl]ethanone
CAS Registry Number 78584-61-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18ClNO
InChI InChI=1S/C14H18ClNO/c1-10(17)14(2)8-9-16(3)13(14)11-4-6-12(15)7-5-11/h4-7,13H,8-9H2,1-3H3/t13-,14-/m1/s1
InChIKey HIXWIHNDXSZPCI-ZIAGYGMSSA-N
Molecular Weight 251.757 g/mol
SMILES [C@@]1([C@](N(C)CC1)(c1ccc(cc1)Cl)[H])(C(=O)C)C
SPLASH splash10-014i-0920000000-318e85fe3088e8173986
Source of Spectrum Y-18-492-0
Synonyms 1-[(2R,3S)-2-(4-chlorophenyl)-1,3-dimethyl-pyrrolidin-3-yl]ethanone
Wiley ID 1254551