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(5S)-[(1S)-1,2-dibenzyloxyethyl]-1-pyrroline N-oxide

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(5S)-[(1S)-1,2-dibenzyloxyethyl]-1-pyrroline N-oxide
SpectraBase Compound ID LDtssE32E9K
InChI InChI=1S/C20H23NO3/c22-21-13-7-12-19(21)20(24-15-18-10-5-2-6-11-18)16-23-14-17-8-3-1-4-9-17/h1-6,8-11,20H,7,12-16H2/t20-/m1/s1
InChIKey LDNFAONUWKYOED-HXUWFJFHSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JnijmRcPDCv
Name (5S)-[(1S)-1,2-dibenzyloxyethyl]-1-pyrroline N-oxide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.167793602 u
Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c22-21-13-7-12-19(21)20(24-15-18-10-5-2-6-11-18)16-23-14-17-8-3-1-4-9-17/h1-6,8-11,20H,7,12-16H2/t20-/m1/s1
InChIKey LDNFAONUWKYOED-HXUWFJFHSA-N
Molecular Weight 325.408 g/mol
SMILES C1(=[N+](CCC1)[O-])[C@@](COCC=1C=CC=CC1)(OCC=1C=CC=CC1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946605