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3-Ethyl-4-propyl-octane

View entire compound with spectra: 1 MS (GC)

3-Ethyl-4-propyl-octane
SpectraBase Compound ID G8y3fiKQXUU
InChI InChI=1S/C13H28/c1-5-9-11-13(10-6-2)12(7-3)8-4/h12-13H,5-11H2,1-4H3
InChIKey XBDFXYBPENMWPB-UHFFFAOYSA-N
Mol Weight 184.37 g/mol
Molecular Formula C13H28
Exact Mass 184.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xP9qErMs5V
Name 3-Ethyl-4-propyl-octane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H28
InChI InChI=1S/C13H28/c1-5-9-11-13(10-6-2)12(7-3)8-4/h12-13H,5-11H2,1-4H3
InChIKey XBDFXYBPENMWPB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cssc.201701789
Molecular Weight 184.367 g/mol
SMILES CCCCC(C(CC)CC)CCC
SPLASH splash10-05fu-9100000000-431c548f4a1e6972d7dd
Source of Spectrum CSC-10-SM6-SM6_1
Synonyms 3-Ethyl-4-propyloctane
Wiley ID 1813561