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Isopropyl 5-Benzyl-2-methylfuran-3-carboxylate
SpectraBase Compound ID G8lbYVkqhKX
InChI InChI=1S/C16H18O3/c1-11(2)18-16(17)15-10-14(19-12(15)3)9-13-7-5-4-6-8-13/h4-8,10-11H,9H2,1-3H3
InChIKey XPKWMYJZUBFQAX-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDALByZC2pi
Name Isopropyl 5-Benzyl-2-methylfuran-3-carboxylate
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.125594437 u
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-11(2)18-16(17)15-10-14(19-12(15)3)9-13-7-5-4-6-8-13/h4-8,10-11H,9H2,1-3H3
InChIKey XPKWMYJZUBFQAX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800046
Molecular Weight 258.317 g/mol
Quality 398
Reported Formula C16H18O3
SMILES C(C)(C)OC(=O)C1=C(OC(=C1)CC1=CC=CC=C1)C
SPLASH splash10-066r-5980000000-6066e9f6a118393ca2b9
Source of Spectrum K1-2018-2559-26 (DOI: 10.1002/ejoc.201800046)
Wiley ID 1891633