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Undecane, 3-methyl-
SpectraBase Compound ID JOirkIHel2c
InChI InChI=1S/C12H26/c1-4-6-7-8-9-10-11-12(3)5-2/h12H,4-11H2,1-3H3
InChIKey HTZWVZNRDDOFEI-UHFFFAOYSA-N
Mol Weight 170.34 g/mol
Molecular Formula C12H26
Exact Mass 170.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNMJdNur5Ye
Name 3-Methylundecane
CAS Registry Number 1002-43-3
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 170.203450837 u
Formula C12H26
InChI InChI=1S/C12H26/c1-4-6-7-8-9-10-11-12(3)5-2/h12H,4-11H2,1-3H3
InChIKey HTZWVZNRDDOFEI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 170.340 g/mol
Nominal Mass 170 u
Quality 986
SMILES C(CCCCCCCC)(CC)C
SPLASH splash10-0a4l-9000000000-848a42ff238fdb0b76f1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-methylundecane
Technique GC/MS
Wiley ID DD2024_034779