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1,4-Diethylhexyl hexanoate

View entire compound with spectra: 1 MS (GC)

1,4-Diethylhexyl hexanoate
SpectraBase Compound ID 1pwMQqg9a0u
InChI InChI=1S/C16H32O2/c1-5-9-10-11-16(17)18-15(8-4)13-12-14(6-2)7-3/h14-15H,5-13H2,1-4H3
InChIKey PITWPEZXOWWWMR-UHFFFAOYSA-N
Mol Weight 256.4 g/mol
Molecular Formula C16H32O2
Exact Mass 256.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcsGMDLD75E
Name 1,4-Diethylhexyl hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H32O2
InChI InChI=1S/C16H32O2/c1-5-9-10-11-16(17)18-15(8-4)13-12-14(6-2)7-3/h14-15H,5-13H2,1-4H3
InChIKey PITWPEZXOWWWMR-UHFFFAOYSA-N
Molecular Weight 256.430 g/mol
SMILES CCC(CC)CCC(CC)OC(=O)CCCCC
SPLASH splash10-006y-9100000000-9a1d1869e7459a03d170
Source of Spectrum NP-7-5004-0
Synonyms Hexanoic acid, 6-ethyl-3-octyl ester Hexanoic acid 6-ethyloctan-3-yl ester 6-Ethyloctan-3-yl hexanoate
Wiley ID 1106545