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4-allyl-2-methoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenol
SpectraBase Compound ID AxW1GCdBOE1
InChI InChI=1S/C21H26N2O2/c1-3-7-17-14-18(21(24)20(15-17)25-2)16-22-10-12-23(13-11-22)19-8-5-4-6-9-19/h3-6,8-9,14-15,24H,1,7,10-13,16H2,2H3
InChIKey WEBWJOLPHRRWDA-UHFFFAOYSA-N
Mol Weight 338.45 g/mol
Molecular Formula C21H26N2O2
Exact Mass 338.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFhKl3IahVF
Name 4-allyl-2-methoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenol
Appearance Red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O2
InChI InChI=1S/C21H26N2O2/c1-3-7-17-14-18(21(24)20(15-17)25-2)16-22-10-12-23(13-11-22)19-8-5-4-6-9-19/h3-6,8-9,14-15,24H,1,7,10-13,16H2,2H3
InChIKey WEBWJOLPHRRWDA-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.1811
Molecular Weight 338.451 g/mol
SMILES Oc1c(cc(cc1OC)CC=C)CN1CCN(CC1)c1ccccc1
SPLASH splash10-05fr-4913000000-dfd5f9c3ec38be749567
Source of Spectrum Y-53-173-173-5
Thin-Layer Chromatography Rf = 0.83 (EtOAc)
Wiley ID 1877536