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4-methylpentyl behenate
SpectraBase Compound ID JBSKS5ofHKZ
InChI InChI=1S/C28H56O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28(29)30-26-23-24-27(2)3/h27H,4-26H2,1-3H3
InChIKey OVXCRTTVMKCCHY-UHFFFAOYSA-N
Mol Weight 424.8 g/mol
Molecular Formula C28H56O2
Exact Mass 424.428031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBVBSfE8ZEt
Name 4-methylpentyl behenate
Appearance White waxy solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H56O2
InChI InChI=1S/C28H56O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28(29)30-26-23-24-27(2)3/h27H,4-26H2,1-3H3
InChIKey OVXCRTTVMKCCHY-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N-Agilent Technologies 5975B
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.201900153
Molecular Weight 424.754 g/mol
SMILES C(=O)(OCCCC(C)C)CCCCCCCCCCCCCCCCCCCCC
SPLASH splash10-052f-9102000000-7852c401243c432397d8
Source of Spectrum CBD-16-SM15-2
Wiley ID 1838398