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1-Benzyloxy-2-methoxy-4-propenyl-benzene
SpectraBase Compound ID EmeQJ4WULBK
InChI InChI=1S/C17H18O2/c1-3-7-14-10-11-16(17(12-14)18-2)19-13-15-8-5-4-6-9-15/h3-12H,13H2,1-2H3/b7-3+
InChIKey YKSSSKBJDZDZTD-XVNBXDOJSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPJuu302GAR
Name Isoeugenol, benzyl ether
CAS Registry Number 120-11-6
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 254.130679818 u
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-3-7-14-10-11-16(17(12-14)18-2)19-13-15-8-5-4-6-9-15/h3-12H,13H2,1-2H3/b7-3+
InChIKey YKSSSKBJDZDZTD-XVNBXDOJSA-N
Molecular Weight 254.329 g/mol
Number of Peaks 50
RI1 2140
RI2 1814
RI3 2438
RI4 2406
RI5 2084
SMILES COc1c(ccc(c1)\C=C\C)OCc1ccccc1
SPLASH splash10-01ox-9820000000-794e6346b9a6efacbc61
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 Benzene, 2-methoxy-1-(phenylmethoxy)-4-(1-propen-1-yl)
Wiley ID LM_FFNSC3_3146