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2-Undecanone
SpectraBase Compound ID 7vrJo8fEGp
InChI InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3
InChIKey KYWIYKKSMDLRDC-UHFFFAOYSA-N
Mol Weight 170.3 g/mol
Molecular Formula C11H22O
Exact Mass 170.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cWggdqVsVb
Name 2-Undecanone
Alternate Name(s) Undecanone<2->
CAS Registry Number 112-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3
InChIKey KYWIYKKSMDLRDC-UHFFFAOYSA-N
Molecular Weight 170.296 g/mol
SMILES C(CCCCCC)CCC(C)=O
SPLASH splash10-0a4l-9000000000-38ceebd7217241f65f67
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887892