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Azelaaldehydic acid, butyl ester

View entire compound with spectra: 1 MS (GC)

Azelaaldehydic acid, butyl ester
SpectraBase Compound ID FgjUFXVHoo4
InChI InChI=1S/C13H24O3/c1-2-3-12-16-13(15)10-8-6-4-5-7-9-11-14/h11H,2-10,12H2,1H3
InChIKey RKCDWVWCNXOCMW-UHFFFAOYSA-N
Mol Weight 228.33 g/mol
Molecular Formula C13H24O3
Exact Mass 228.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3h7RzZqmP2
Name Azelaaldehydic acid, butyl ester
CAS Registry Number 2649-93-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O3
InChI InChI=1S/C13H24O3/c1-2-3-12-16-13(15)10-8-6-4-5-7-9-11-14/h11H,2-10,12H2,1H3
InChIKey RKCDWVWCNXOCMW-UHFFFAOYSA-N
Molecular Weight 228.332 g/mol
SMILES C(C(OCCCC)=O)CCCCCCC=O
SPLASH splash10-0a4i-9300000000-626be0c7dae704e36c1d
Source of Spectrum W5-19400-0-0
Synonyms Butyl 9-oxononanoate 9-ketopelargonic acid butyl ester 9-Oxononanoic acid butyl ester Butyl 9-oxidanylidenenonanoate
Wiley ID 1229750