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cis-8,11,14-Eicosatrienoic acid, 4,4-dimethyloxazoline (dmox) derivative

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cis-8,11,14-Eicosatrienoic acid, 4,4-dimethyloxazoline (dmox) derivative
SpectraBase Compound ID KQN1vr3slBa
InChI InChI=1S/C24H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25-24(2,3)22-26-23/h8-9,11-12,14-15H,4-7,10,13,16-22H2,1-3H3/b9-8-,12-11-,15-14-
InChIKey KWSGHOHBFKRYBP-ORZIMQNZSA-N
Mol Weight 359.6 g/mol
Molecular Formula C24H41NO
Exact Mass 359.318815 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HYfdonuYPDN
Name cis-8,11,14-Eicosatrienoic acid, 4,4-dimethyloxazoline (dmox) derivative
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.318814943 u
Formula C24H41NO
InChI InChI=1S/C24H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25-24(2,3)22-26-23/h8-9,11-12,14-15H,4-7,10,13,16-22H2,1-3H3/b9-8-,12-11-,15-14-
InChIKey KWSGHOHBFKRYBP-ORZIMQNZSA-N
Molecular Weight 359.598 g/mol
SMILES C=1(OCC(N1)(C)C)CCCCCC\C=C/C\C=C/C\C=C/CCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.922521