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(S)-2-[(2-Methoxyethoxy)methoxymethyl]-1-(1-butyl-3-phenylpropylidenamino)pyrrolidine
SpectraBase Compound ID JHkexOmplEF
InChI InChI=1S/C22H36N2O3/c1-4-5-12-20(15-14-19-10-7-6-8-11-19)23-24-16-9-13-21(24)22(26-3)27-18-17-25-2/h6-8,10-11,21-22H,4-5,9,12-18H2,1-3H3/b23-20+/t21?,22-/m0/s1
InChIKey MSHVLFZEIZPBMZ-BYRSLXDQSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H36N2O3
Exact Mass 376.272593 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9LIvrinNM7q
Name (S)-2-[(2-Methoxyethoxy)methoxymethyl]-1-(1-butyl-3-phenylpropylidenamino)pyrrolidine
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 376.272593024 u
Formula C22H36N2O3
InChI InChI=1S/C22H36N2O3/c1-4-5-12-20(15-14-19-10-7-6-8-11-19)23-24-16-9-13-21(24)22(26-3)27-18-17-25-2/h6-8,10-11,21-22H,4-5,9,12-18H2,1-3H3/b23-20+/t21?,22-/m0/s1
InChIKey MSHVLFZEIZPBMZ-BYRSLXDQSA-N
Molecular Weight 376.541 g/mol
SMILES C1(N(CCC1)\N=C\(CCC=1C=CC=CC1)CCCC)[C@@](OC)(OCCOC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941762