SpectraBase Compound ID | 86Zc53GmFDt |
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InChI | InChI=1S/C16H30/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h9-12H,3-8,13-16H2,1-2H3/b11-9-,12-10- |
InChIKey | QWHCCQFISUXBCY-HWAYABPNSA-N |
Mol Weight | 222.42 g/mol |
Molecular Formula | C16H30 |
Exact Mass | 222.234751 g/mol |
SpectraBase Spectrum ID | 14wPkJ7QY5k |
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Name | 5,11-Hexadecadiene, (Z,Z)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 222.234750966 u |
Formula | C16H30 |
InChI | InChI=1S/C16H30/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h9-12H,3-8,13-16H2,1-2H3/b11-9-,12-10- |
InChIKey | QWHCCQFISUXBCY-HWAYABPNSA-N |
Molecular Weight | 222.416 g/mol |
SMILES | C(\C=C/CCCC)CCC\C=C/CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967938 |