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Kryptofix 22DD

View entire compound with spectra: 1 FTIR

Kryptofix 22DD
SpectraBase Compound ID 4yySQze1rpz
InChI InChI=1S/C32H66N2O4/c1-3-5-7-9-11-13-15-17-19-33-21-25-35-29-31-37-27-23-34(24-28-38-32-30-36-26-22-33)20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
InChIKey WUHOJKXEIIYUSL-UHFFFAOYSA-N
Mol Weight 542.9 g/mol
Molecular Formula C32H66N2O4
Exact Mass 542.502259 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FYEHigTbz6
Name Kryptofix 22DD
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 542.502258609 u
Formula C32H66N2O4
InChI InChI=1S/C32H66N2O4/c1-3-5-7-9-11-13-15-17-19-33-21-25-35-29-31-37-27-23-34(24-28-38-32-30-36-26-22-33)20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
InChIKey WUHOJKXEIIYUSL-UHFFFAOYSA-N
Molecular Weight 542.890 g/mol
SMILES CCCCCCCCCCN1CCOCCOCCN(CCCCCCCCCC)CCOCCOCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847927