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Hexanoic acid, 2-ethyl-, octadecyl ester
SpectraBase Compound ID 6O2dt8nv4dZ
InChI InChI=1S/C26H52O2/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-28-26(27)25(6-3)23-8-5-2/h25H,4-24H2,1-3H3
InChIKey PIUVNPNBPWVVKZ-UHFFFAOYSA-N
Mol Weight 396.7 g/mol
Molecular Formula C26H52O2
Exact Mass 396.396731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8tDgngkdJHm
Name Hexanoic acid, 2-ethyl-, octadecyl ester
Alternate Name(s) Octadecyl 2-ethylhexanoate 2-Ethylhexanoic acid stearyl ester EINECS 261-620-7
CAS Registry Number 59130-70-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H52O2
InChI InChI=1S/C26H52O2/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-28-26(27)25(6-3)23-8-5-2/h25H,4-24H2,1-3H3
InChIKey PIUVNPNBPWVVKZ-UHFFFAOYSA-N
Molecular Weight 396.700 g/mol
SMILES C(CCC)C(C(=O)OCCCCCCCCCCCCCCCCCC)CC
SPLASH splash10-0002-3900000000-281d7ae392f95313cc6e
Source of Spectrum O-22-474-10
Wiley ID 1367728