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4-Ethylheptane
SpectraBase Compound ID 2O5TcTUPlNJ
InChI InChI=1S/C9H20/c1-4-7-9(6-3)8-5-2/h9H,4-8H2,1-3H3
InChIKey XMROPFQWHHUFFS-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 F9JJ8jnr721
Name Heptane, 4-ethyl-
CAS Registry Number 2216-32-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H20
InChI InChI=1S/C9H20/c1-4-7-9(6-3)8-5-2/h9H,4-8H2,1-3H3
InChIKey XMROPFQWHHUFFS-UHFFFAOYSA-N
Molecular Weight 128.259 g/mol
SMILES C(CCC)(CCC)CC
SPLASH splash10-052f-9000000000-1e6813b7b067bd7d86c0
Source of Spectrum S4-1355-0-0
Synonyms 4-Ethylheptane
Wiley ID 1131842