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Cyclohexacosa-1,14-diyne

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

Cyclohexacosa-1,14-diyne
SpectraBase Compound ID E7HC4SUj2fZ
InChI InChI=1S/C26H44/c1-2-4-6-8-10-12-14-16-18-20-22-24-26-25-23-21-19-17-15-13-11-9-7-5-3-1/h1-11,16-26H2
InChIKey YUPONOMCGGTYKA-UHFFFAOYSA-N
Mol Weight 356.6 g/mol
Molecular Formula C26H44
Exact Mass 356.344301 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FTuQOiCvtdK
Name Cyclohexacosa-1,14-diyne
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.344301417 u
Formula C26H44
InChI InChI=1S/C26H44/c1-2-4-6-8-10-12-14-16-18-20-22-24-26-25-23-21-19-17-15-13-11-9-7-5-3-1/h1-11,16-26H2
InChIKey YUPONOMCGGTYKA-UHFFFAOYSA-N
Molecular Weight 356.638 g/mol
SMILES C1#CCCCCCCCCCCCC#CCCCCCCCCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963224