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2,2,5-Trimethylhexane

View entire compound with spectra: 11 NMR, 5 FTIR, and 8 MS (GC)

2,2,5-Trimethylhexane
SpectraBase Compound ID EAYgvRvpiQA
InChI InChI=1S/C9H20/c1-8(2)6-7-9(3,4)5/h8H,6-7H2,1-5H3
InChIKey HHOSMYBYIHNXNO-UHFFFAOYSA-N
Mol Weight 128.26 g/mol
Molecular Formula C9H20
Exact Mass 128.156501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BRrt3kX9jWS
Name 2,2,5-TRIMETHYLHEXANE
Source of Sample MCB Manufacturing Chemists, Norwood, Ohio
Boiling Point 124.6C
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9 H20
InChI InChI=1S/C9H20/c1-8(2)6-7-9(3,4)5/h8H,6-7H2,1-5H3
InChIKey HHOSMYBYIHNXNO-UHFFFAOYSA-N
Molecular Weight 128.26
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3
Synonyms HEXANE, 2,2,5-TRIMETHYL-,