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1-(3-Tolyl)-dodecan-1-one
SpectraBase Compound ID 5sLTDLtIoWz
InChI InChI=1S/C19H30O/c1-3-4-5-6-7-8-9-10-11-15-19(20)18-14-12-13-17(2)16-18/h12-14,16H,3-11,15H2,1-2H3
InChIKey YQMXDRCQMZPXTG-UHFFFAOYSA-N
Mol Weight 274.45 g/mol
Molecular Formula C19H30O
Exact Mass 274.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID O5L0lcO4e
Name 1-(3-Tolyl)-dodecan-1-one
Alternate Name(s) 1-(m-tolyl)dodecan-1-one 1-(3-Methylphenyl)-1-dodecanone 1-(3-Methylphenyl)dodecan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O
InChI InChI=1S/C19H30O/c1-3-4-5-6-7-8-9-10-11-15-19(20)18-14-12-13-17(2)16-18/h12-14,16H,3-11,15H2,1-2H3
InChIKey YQMXDRCQMZPXTG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000429
Molecular Weight 274.448 g/mol
SMILES C(CCCCCCCCCCC)(=O)c1cc(ccc1)C
SPLASH splash10-0159-1900000000-8b1454d709b47b540536
Source of Spectrum ASC-353-57/SM8-3ae
Wiley ID 1764545