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Heptane, 5-ethyl-2-methyl-
SpectraBase Compound ID IN1exphQ8AI
InChI InChI=1S/C10H22/c1-5-10(6-2)8-7-9(3)4/h9-10H,5-8H2,1-4H3
InChIKey DGEMPTLPTFNEHJ-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 28PcCXc1RI
Name Heptane, 5-ethyl-2-methyl-
CAS Registry Number 13475-78-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H22
InChI InChI=1S/C10H22/c1-5-10(6-2)8-7-9(3)4/h9-10H,5-8H2,1-4H3
InChIKey DGEMPTLPTFNEHJ-UHFFFAOYSA-N
Molecular Weight 142.286 g/mol
SMILES C(CCC(C)C)(CC)CC
SPLASH splash10-0596-9000000000-d2692323224859c7b3f8
Source of Spectrum AA-0-781-3
Synonyms 2-Methyl-5-ethylheptane 5-Ethyl-2-methyl-heptane 6-Methyl-3-ethylheptane Heptane, 3-ethyl-6-methyl 5-Ethyl-2-methylheptane
Wiley ID 8396