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(2E)-3-[4'-methoxy-3'-(tetrahydropyranyloxhexyl)]phenyl-1-(2',3',4'-trimethoxyphenyl)prop-2-en-1-one
SpectraBase Compound ID GJtTTwRkrvP
InChI InChI=1S/C30H40O8/c1-32-25-15-13-22(12-14-24(31)23-20-27(33-2)30(35-4)28(21-23)34-3)19-26(25)36-16-8-5-6-9-17-37-29-11-7-10-18-38-29/h12-15,19-21,29H,5-11,16-18H2,1-4H3/b14-12+
InChIKey RCLJJLNINOIJMN-WYMLVPIESA-N
Mol Weight 528.6 g/mol
Molecular Formula C30H40O8
Exact Mass 528.272318 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYpkGk7HQff
Name (2E)-3-[4'-methoxy-3'-(tetrahydropyranyloxhexyl)]phenyl-1-(2',3',4'-trimethoxyphenyl)prop-2-en-1-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40O8
InChI InChI=1S/C30H40O8/c1-32-25-15-13-22(12-14-24(31)23-20-27(33-2)30(35-4)28(21-23)34-3)19-26(25)36-16-8-5-6-9-17-37-29-11-7-10-18-38-29/h12-15,19-21,29H,5-11,16-18H2,1-4H3/b14-12+
InChIKey RCLJJLNINOIJMN-WYMLVPIESA-N
Instrument Name VARIAN MAT 311A
Ionization Type EI
Literature Reference DOI 10.1021/jm801001d
Molecular Weight 528.642 g/mol
SMILES c1(cc(ccc1OC)\C=C\C(c1cc(c(c(c1)OC)OC)OC)=O)OCCCCCCOC1CCCCO1
SPLASH splash10-002o-9204210000-8beaccd63da82d513b12
Source of Spectrum AF-52-SM3-2b
Thin-Layer Chromatography Rf = 0.22 (ethyl acetate/hexane, 1:2)
Wiley ID 1873636