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2-Ethylhexyl hexanoate

View entire compound with spectra: 2 MS (GC)

2-Ethylhexyl hexanoate
SpectraBase Compound ID LybNTafNeLf
InChI InChI=1S/C14H28O2/c1-4-7-9-11-14(15)16-12-13(6-3)10-8-5-2/h13H,4-12H2,1-3H3
InChIKey QRNFTMKPBPCPJO-UHFFFAOYSA-N
Mol Weight 228.38 g/mol
Molecular Formula C14H28O2
Exact Mass 228.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIeYORE1zmU
Name 2-Ethylhexyl hexanoate
CAS Registry Number 16397-75-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28O2
InChI InChI=1S/C14H28O2/c1-4-7-9-11-14(15)16-12-13(6-3)10-8-5-2/h13H,4-12H2,1-3H3
InChIKey QRNFTMKPBPCPJO-UHFFFAOYSA-N
Molecular Weight 228.376 g/mol
SMILES C(=O)(OCC(CC)CCCC)CCCCC
SPLASH splash10-05bf-9000000000-bc88ef02a63114d33890
Source of Spectrum NW-1697-0-0
Synonyms Hexanoic acid 2-ethylhexyl ester
Wiley ID 561035