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Heneicosane, 11-decyl-

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Heneicosane, 11-decyl-
SpectraBase Compound ID 3JYrt5eH5wg
InChI InChI=1S/C31H64/c1-4-7-10-13-16-19-22-25-28-31(29-26-23-20-17-14-11-8-5-2)30-27-24-21-18-15-12-9-6-3/h31H,4-30H2,1-3H3
InChIKey BCWYKEQUGMQGAP-UHFFFAOYSA-N
Mol Weight 436.9 g/mol
Molecular Formula C31H64
Exact Mass 436.500802 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HleRCKMCPqm
Name Heneicosane, 11-decyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.500802061 u
Formula C31H64
InChI InChI=1S/C31H64/c1-4-7-10-13-16-19-22-25-28-31(29-26-23-20-17-14-11-8-5-2)30-27-24-21-18-15-12-9-6-3/h31H,4-30H2,1-3H3
InChIKey BCWYKEQUGMQGAP-UHFFFAOYSA-N
Molecular Weight 436.853 g/mol
SMILES C(C(CCCCCCCCCC)CCCCCCCCCC)CCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.868925