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(S,S)-1-(2-Dibenzylamino-2-isopropylacetaldehyde)-2-methoxymethylpyrrolidinehydrazone
SpectraBase Compound ID LrwoJVvI1pT
InChI InChI=1S/C25H35N3O/c1-21(2)25(17-26-28-16-10-15-24(28)20-29-3)27(18-22-11-6-4-7-12-22)19-23-13-8-5-9-14-23/h4-9,11-14,17,21,24-25H,10,15-16,18-20H2,1-3H3/b26-17+/t24-,25-/m0/s1
InChIKey CJHXTBOLTUVDSV-PJZSAHDYSA-N
Mol Weight 393.6 g/mol
Molecular Formula C25H35N3O
Exact Mass 393.278013 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1HdCdzQMqrX
Name (S,S)-1-(2-Dibenzylamino-2-isopropylacetaldehyde)-2-methoxymethylpyrrolidinehydrazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.278012758 u
Formula C25H35N3O
InChI InChI=1S/C25H35N3O/c1-21(2)25(17-26-28-16-10-15-24(28)20-29-3)27(18-22-11-6-4-7-12-22)19-23-13-8-5-9-14-23/h4-9,11-14,17,21,24-25H,10,15-16,18-20H2,1-3H3/b26-17+/t24-,25-/m0/s1
InChIKey CJHXTBOLTUVDSV-PJZSAHDYSA-N
Molecular Weight 393.575 g/mol
SMILES [C@@](N(CC=1C=CC=CC1)CC1=CC=CC=C1)(\C=N\N1[C@](COC)(CCC1)[H])(C(C)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.859797