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3,4,5-TRIMETHYL-HEPTANE;(DIASTEREOMER-1)
SpectraBase Compound ID 4OTJS9oQu19
InChI InChI=1S/C10H22/c1-6-8(3)10(5)9(4)7-2/h8-10H,6-7H2,1-5H3
InChIKey LJIIBBYARMPSMT-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 B1H1ILVPvEm
Name 3,4,5-Trimethylheptane
Alternate Name(s) Heptane, 3,4,5-trimethyl-
CAS Registry Number 20278-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H22
InChI InChI=1S/C10H22/c1-6-8(3)10(5)9(4)7-2/h8-10H,6-7H2,1-5H3
InChIKey LJIIBBYARMPSMT-UHFFFAOYSA-N
Molecular Weight 142.286 g/mol
SMILES CC(CC)C(C)C(C)CC
SPLASH splash10-0006-9000000000-02ae1612a362df80103b
Source of Spectrum HE-1986-958-0
Wiley ID 1141696