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3-Methyl-N-pentpylaniline
SpectraBase Compound ID CuQdswtGTyR
InChI InChI=1S/C12H19N/c1-3-4-5-9-13-12-8-6-7-11(2)10-12/h6-8,10,13H,3-5,9H2,1-2H3
InChIKey KHCRBCUSPQYZBD-UHFFFAOYSA-N
Mol Weight 177.29 g/mol
Molecular Formula C12H19N
Exact Mass 177.15175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2p4wRbEoZvs
Name 3-Methyl-N-pentpylaniline
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 177.151749616 u
Formula C12H19N
InChI InChI=1S/C12H19N/c1-3-4-5-9-13-12-8-6-7-11(2)10-12/h6-8,10,13H,3-5,9H2,1-2H3
InChIKey KHCRBCUSPQYZBD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 177.291 g/mol
Nominal Mass 177 u
Quality 990
Retention Index 1497
SMILES C=1(NCCCCC)C=C(C=CC1)C
SPLASH splash10-00di-2900000000-9801db9eb132ccb2d74a
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028157