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2-ketovaleric acid 3,7-dimethyloct-6-enyl ester
SpectraBase Compound ID GVJAiqVmXz5
InChI InChI=1S/C15H26O3/c1-5-7-14(16)15(17)18-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3
InChIKey ITONWBLTESQENH-UHFFFAOYSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAIhgi1ttOi
Name 2-ketovaleric acid 3,7-dimethyloct-6-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-5-7-14(16)15(17)18-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3
InChIKey ITONWBLTESQENH-UHFFFAOYSA-N
Molecular Weight 254.370 g/mol
SMILES C(C(=O)CCC)(=O)OCCC(CCC=C(C)C)C
SPLASH splash10-00rx-9100000000-0b0c32bf6dd8fdd5b6ca
Source of Spectrum H-83-1664-3
Synonyms 2-Oxopentanoic acid 3,7-dimethyloct-6-enyl ester 3,7-Dimethyl-6-octenyl 2-oxopentanoate 3,7-Dimethyloct-6-enyl 2-oxidanylidenepentanoate 3,7-Dimethyloct-6-enyl 2-oxopentanoate
Wiley ID 847122