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Frutinat
SpectraBase Compound ID 4zAsBaMnW2Z
InChI InChI=1S/C10H18O2/c1-5-6-10(11)12-9(4)7-8(2)3/h5-6,8-9H,7H2,1-4H3/b6-5+
InChIKey VCLJLOIXTASTGU-AATRIKPKSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Imvsu3cdw9
Name Frutinat
Source of Sample Standard L'Oreal
CAS Registry Number 35206-51-0
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 170.130679818 u
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-5-6-10(11)12-9(4)7-8(2)3/h5-6,8-9H,7H2,1-4H3/b6-5+
InChIKey VCLJLOIXTASTGU-AATRIKPKSA-N
Molecular Weight 170.252 g/mol
Number of Peaks 50
RI1 1117
RI2 793
RI3 789
RI4 741
SMILES C(\C=C\C)(=O)OC(CC(C)C)C
SPLASH splash10-014l-9000000000-263c90c7cbae32175707
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 2-Butenoic acid, 1,3-dimethylbutyl ester
Wiley ID LM_FFNSC3_3044