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(+)-(3S,4R)-3-[[2(S)-[(methoxymethoxy)methyl]pyrrolidinyl]carbonyl]-4-phenylcyclohex-1-ene
SpectraBase Compound ID KBFrhlu1clw
InChI InChI=1S/C20H27NO3/c1-23-15-24-14-17-10-7-13-21(17)20(22)19-12-6-5-11-18(19)16-8-3-2-4-9-16/h2-4,6,8-9,12,17-19H,5,7,10-11,13-15H2,1H3/t17-,18-,19-/m0/s1
InChIKey UBYUNTKSJSZDPV-FHWLQOOXSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NbDxd6Qe1a
Name (+)-(3S,4R)-3-[[2(S)-[(methoxymethoxy)methyl]pyrrolidinyl]carbonyl]-4-phenylcyclohex-1-ene
Alternate Name(s) (2S)-2-[(methoxymethoxy)methyl]-1-{[(1S,6R)-6-phenyl-2-cyclohexen-1-yl]carbonyl}pyrrolidine
CAS Registry Number 113133-25-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-23-15-24-14-17-10-7-13-21(17)20(22)19-12-6-5-11-18(19)16-8-3-2-4-9-16/h2-4,6,8-9,12,17-19H,5,7,10-11,13-15H2,1H3/t17-,18-,19-/m0/s1
InChIKey UBYUNTKSJSZDPV-FHWLQOOXSA-N
Molecular Weight 329.440 g/mol
SMILES C(N1[C@](COCOC)(CCC1)[H])([C@@]1([C@](c2ccccc2)(CCC=C1)[H])[H])=O
SPLASH splash10-00dl-9400000000-1e474eb7c52f4e2766f6
Source of Spectrum J-53-2461-5
Wiley ID 1327246