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(S)-N-(4,4-Diphenyl-3-butenyl)prolinol

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

(S)-N-(4,4-Diphenyl-3-butenyl)prolinol
SpectraBase Compound ID GJze9BVVMgS
InChI InChI=1S/C21H25NO/c23-17-20-13-7-15-22(20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20,23H,7-8,13,15-17H2/t20-/m0/s1
InChIKey KQWUIGDOZMJCML-FQEVSTJZSA-N
Mol Weight 307.44 g/mol
Molecular Formula C21H25NO
Exact Mass 307.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3DL3b0h0vhN
Name (S)-N-(4,4-Diphenyl-3-butenyl)prolinol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.193614428 u
Formula C21H25NO
InChI InChI=1S/C21H25NO/c23-17-20-13-7-15-22(20)16-8-14-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14,20,23H,7-8,13,15-17H2/t20-/m0/s1
InChIKey KQWUIGDOZMJCML-FQEVSTJZSA-N
SMILES C(=CCCN1[C@](CO)(CCC1)[H])(C1=CC=CC=C1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913635