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2-(E-prop-1-enyl)-cyclotridecan-1-one
SpectraBase Compound ID 7AK4r98JLwz
InChI InChI=1S/C16H28O/c1-2-12-15-13-10-8-6-4-3-5-7-9-11-14-16(15)17/h2,12,15H,3-11,13-14H2,1H3/b12-2+
InChIKey UTYJJRWIMRPOCD-SWGQDTFXSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RZOXHgNhdn
Name 2-(E-prop-1-enyl)-cyclotridecan-1-one
Classification Cyclic ketones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 236.214015521 u
Formula C16H28O
InChI InChI=1S/C16H28O/c1-2-12-15-13-10-8-6-4-3-5-7-9-11-14-16(15)17/h2,12,15H,3-11,13-14H2,1H3/b12-2+
InChIKey UTYJJRWIMRPOCD-SWGQDTFXSA-N
Molecular Weight 236.399 g/mol
Number of Peaks 8
SMILES C1CCC(C(CCCCCCCC1)=O)\C=C\C
SPLASH splash10-0api-9000000000-04d13ad50ba1c743a96d
Source of Spectrum FF-4-5-28 (DOI: 10.1002/ffj.2730040102)
Synonyms (E)-2-(prop-1-en-1-yl)cyclotridecan-1-one
Wiley ID 1801181