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13-Oxo-trideca-9E,11E-dienoic acid

View entire compound with spectra: 1 MS (GC)

13-Oxo-trideca-9E,11E-dienoic acid
SpectraBase Compound ID ArwmCd6jdYk
InChI InChI=1S/C13H20O3/c14-12-10-8-6-4-2-1-3-5-7-9-11-13(15)16/h4,6,8,10,12H,1-3,5,7,9,11H2,(H,15,16)/b6-4+,10-8+
InChIKey XHDHWGKEDVWKAN-ONNLMXTPSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VCwTmAWoZh
Name 13-Oxo-trideca-9E,11E-dienoic acid
Alternate Name(s) (9E,11E)-13-oxotrideca-9,11-dienoic acid (9E,11E)-13-oxidanylidenetrideca-9,11-dienoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c14-12-10-8-6-4-2-1-3-5-7-9-11-13(15)16/h4,6,8,10,12H,1-3,5,7,9,11H2,(H,15,16)/b6-4+,10-8+
InChIKey XHDHWGKEDVWKAN-ONNLMXTPSA-N
Molecular Weight 224.300 g/mol
SMILES OC(=O)CCCCCCC\C=C\C=C\C=O
SPLASH splash10-001i-9210000000-3231e8272a3c6976daa9
Source of Spectrum F-59-3007-8a
Wiley ID 1712218