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3-Dodecanone
SpectraBase Compound ID 29SgB4Bsm45
InChI InChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12(13)4-2/h3-11H2,1-2H3
InChIKey PERIHWAPLOBAJM-UHFFFAOYSA-N
Mol Weight 184.32 g/mol
Molecular Formula C12H24O
Exact Mass 184.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48tW4l4AoAi
Name 3-Dodecanone
CAS Registry Number 1534-27-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O
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/C12H24O/c1-3-5-6-7-8-9-10-11-12(13)4-2/h3-11H2,1-2H3
InChIKey PERIHWAPLOBAJM-UHFFFAOYSA-N
Molecular Weight 184.323 g/mol
SMILES C(CCCCCCCC)C(CC)=O
SPLASH splash10-0abc-9000000000-304270fcdcdc9aad17a2
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Dodecanone<3->
Wiley ID 1887332