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Palmitaldehyde, diisopentyl acetal
SpectraBase Compound ID 6CwjPue57ct
InChI InChI=1S/C26H54O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(27-22-20-24(2)3)28-23-21-25(4)5/h24-26H,6-23H2,1-5H3
InChIKey KBPNNHFVJQEULH-UHFFFAOYSA-N
Mol Weight 398.7 g/mol
Molecular Formula C26H54O2
Exact Mass 398.412381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQvWbxwngJY
Name Palmitaldehyde, diisopentyl acetal
Alternate Name(s) 1,1-Bis(isopentyloxy)hexadecane 1,1-bis(3-methylbutoxy)hexadecane 1,1-Diisoamoxyhexadecane 1,1-Diisopentyloxyhexadecane Hexadecanal diisopentyl acetal
CAS Registry Number 18302-71-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H54O2
InChI InChI=1S/C26H54O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(27-22-20-24(2)3)28-23-21-25(4)5/h24-26H,6-23H2,1-5H3
InChIKey KBPNNHFVJQEULH-UHFFFAOYSA-N
Molecular Weight 398.716 g/mol
SMILES C(CCCCCCCCCCCCCCC)(OCCC(C)C)OCCC(C)C
SPLASH splash10-0596-9000000000-d2ab35da60804c960558
Source of Spectrum EP-4919-0-0
Wiley ID 1368664