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2,6-dimethylheptane
SpectraBase Compound ID JE0p1vmam2V
InChI InChI=1S/C9H20/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3
InChIKey KBPCCVWUMVGXGF-UHFFFAOYSA-N
Mol Weight 128.26 g/mol
Molecular Formula C9H20
Exact Mass 128.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IpVDb1a56W
Name Heptane, 2,6-dimethyl-
CAS Registry Number 1072-05-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H20
InChI InChI=1S/C9H20/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3
InChIKey KBPCCVWUMVGXGF-UHFFFAOYSA-N
Molecular Weight 128.259 g/mol
SMILES CC(C)CCCC(C)C
SPLASH splash10-052f-9000000000-12efb5f8ad4fd9b0d27d
Source of Spectrum IC-135-0-0
Synonyms 2,6-Dimethylheptane
Wiley ID 1131855