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4-Benzyloxy-1-methoxy-2-(prop-1'-enyl)anthraquinone
SpectraBase Compound ID KbUeWvmFIMb
InChI InChI=1S/C25H20O4/c1-3-9-17-14-20(29-15-16-10-5-4-6-11-16)21-22(25(17)28-2)24(27)19-13-8-7-12-18(19)23(21)26/h3-14H,15H2,1-2H3/b9-3+
InChIKey YFLXYJHEGKODQF-YCRREMRBSA-N
Mol Weight 384.43 g/mol
Molecular Formula C25H20O4
Exact Mass 384.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vr1NbcsWFo
Name 4-Benzyloxy-1-methoxy-2-(prop-1'-enyl)anthraquinone
Alternate Name(s) 4-(benzyloxy)-1-methoxy-2-[(1E)-1-propenyl]anthra-9,10-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20O4
InChI InChI=1S/C25H20O4/c1-3-9-17-14-20(29-15-16-10-5-4-6-11-16)21-22(25(17)28-2)24(27)19-13-8-7-12-18(19)23(21)26/h3-14H,15H2,1-2H3/b9-3+
InChIKey YFLXYJHEGKODQF-YCRREMRBSA-N
Molecular Weight 384.431 g/mol
SMILES c12c(C(=O)c3c(C2=O)cccc3)c(OC)c(cc1OCc1ccccc1)\C=C\C
SPLASH splash10-0006-9015000000-6adb14c527974eb1cfe5
Source of Spectrum B-47-1295-0
Wiley ID 1361840