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Butyl butyryllactate
SpectraBase Compound ID FD0pRuSBBU3
InChI InChI=1S/C11H20O4/c1-4-6-8-14-11(13)9(3)15-10(12)7-5-2/h9H,4-8H2,1-3H3
InChIKey NORZZKKLCYMBBF-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F871dQsVUnn
Name Butyryllactate
Source of Sample SAFC Cat.no. W219002
CAS Registry Number 7492-70-8
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 216.136159120 u
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-4-6-8-14-11(13)9(3)15-10(12)7-5-2/h9H,4-8H2,1-3H3
InChIKey NORZZKKLCYMBBF-UHFFFAOYSA-N
Molecular Weight 216.277 g/mol
Number of Peaks 50
RI1 1357
RI2 1035
RI3 1142
RI4 1100
SMILES CCCCOC(C(OC(CCC)=O)C)=O
SPLASH splash10-00di-9100000000-9691f226857a9aa45411
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Butanoic acid, 2-butoxy-1-methyl-2-oxoethyl ester
Wiley ID LM_FFNSC3_202