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Cinnamate <4-methoxy-, isopentyl->
SpectraBase Compound ID 4rC015a2G08
InChI InChI=1S/C15H20O3/c1-12(2)10-11-18-15(16)9-6-13-4-7-14(17-3)8-5-13/h4-9,12H,10-11H2,1-3H3/b9-6+
InChIKey UBNYRXMKIIGMKK-RMKNXTFCSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmUDrSGksFt
Name Cinnamate <4-methoxy-, isopentyl->
CAS Registry Number 71617-10-2
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 248.141244501 u
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-12(2)10-11-18-15(16)9-6-13-4-7-14(17-3)8-5-13/h4-9,12H,10-11H2,1-3H3/b9-6+
InChIKey UBNYRXMKIIGMKK-RMKNXTFCSA-N
Molecular Weight 248.322 g/mol
Number of Peaks 50
RI1 2042
RI2 1717
SMILES c1(ccc(cc1)OC)\C=C\C(OCCC(C)C)=O
SPLASH splash10-01t9-2900000000-8028766c878a965d68b5
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-Propenoic acid, 3-(4-methoxyphenyl)-, 3-methylbutyl ester
Wiley ID LM_FFNSC3_1669