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Heptane, 3,3,4-trimethyl-
SpectraBase Compound ID 8MwU69Y7UpV
InChI InChI=1S/C10H22/c1-6-8-9(3)10(4,5)7-2/h9H,6-8H2,1-5H3
InChIKey WRBHKVWLEIYLDZ-UHFFFAOYSA-N
Mol Weight 142.29 g/mol
Molecular Formula C10H22
Exact Mass 142.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GykACgXaIf
Name Heptane, 3,3,4-trimethyl-
Alternate Name(s) 3,3,4-Trimethylheptane 3,4,5-Triemthylheptane
CAS Registry Number 20278-87-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H22
InChI InChI=1S/C10H22/c1-6-8-9(3)10(4,5)7-2/h9H,6-8H2,1-5H3
InChIKey WRBHKVWLEIYLDZ-UHFFFAOYSA-N
Molecular Weight 142.286 g/mol
SMILES CC(CC)(C)C(C)CCC
SPLASH splash10-00dl-9000000000-f82dac59e681a363f7b4
Source of Spectrum HE-1982-0-0
Wiley ID 1141690