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cis,cis-7,10,-Hexadecadienal

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cis,cis-7,10,-Hexadecadienal
SpectraBase Compound ID RLSKI99cR0
InChI InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h6-7,9-10,16H,2-5,8,11-15H2,1H3/b7-6-,10-9-
InChIKey WIWVOAOSGQCJSL-HZJYTTRNSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JpIkmR9NZ2K
Name cis,cis-7,10,-Hexadecadienal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 236.214015521 u
Formula C16H28O
InChI InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h6-7,9-10,16H,2-5,8,11-15H2,1H3/b7-6-,10-9-
InChIKey WIWVOAOSGQCJSL-HZJYTTRNSA-N
Molecular Weight 236.399 g/mol
SMILES C(\C=C/CCCCC)\C=C/CCCCCC=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973552