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1-(Piperidin-1-yl)hexadecan-1-one
SpectraBase Compound ID IhvmQP4RG2V
InChI InChI=1S/C21H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(23)22-19-16-14-17-20-22/h2-20H2,1H3
InChIKey SBWUACYNOBUPAH-UHFFFAOYSA-N
Mol Weight 323.6 g/mol
Molecular Formula C21H41NO
Exact Mass 323.318815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGLBtUyamCu
Name 1-(Piperidin-1-yl)hexadecan-1-one
CAS Registry Number 4629-02-1
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 323.318814943 u
Formula C21H41NO
InChI InChI=1S/C21H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(23)22-19-16-14-17-20-22/h2-20H2,1H3
InChIKey SBWUACYNOBUPAH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 323.565 g/mol
Nominal Mass 323 u
Quality 993
Retention Index 2383
SMILES C(N1CCCCC1)(CCCCCCCCCCCCCCC)=O
SPLASH splash10-004i-4900000000-386a169bd4b0baa07b26
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(piperidin-1-yl)hexadecan-1-one
Technique GC/MS
Wiley ID DD2024_032578