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2-allyl-4,6-dimethoxy-5-methyl-3-(phenoxymethyl)aniline
SpectraBase Compound ID 9Gv8Y8s6BCi
InChI InChI=1S/C19H23NO3/c1-5-9-15-16(12-23-14-10-7-6-8-11-14)18(21-3)13(2)19(22-4)17(15)20/h5-8,10-11H,1,9,12,20H2,2-4H3
InChIKey WYCDIIJWRFXAOM-UHFFFAOYSA-N
Mol Weight 313.4 g/mol
Molecular Formula C19H23NO3
Exact Mass 313.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nTdkrYElZI
Name 2-allyl-4,6-dimethoxy-5-methyl-3-(phenoxymethyl)aniline
Appearance Yellowish solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.167793602 u
Formula C19H23NO3
InChI InChI=1S/C19H23NO3/c1-5-9-15-16(12-23-14-10-7-6-8-11-14)18(21-3)13(2)19(22-4)17(15)20/h5-8,10-11H,1,9,12,20H2,2-4H3
InChIKey WYCDIIJWRFXAOM-UHFFFAOYSA-N
Instrument Name Thermo Scientific Orbitrap Fusion system
Ionization Type EI
Literature Reference DOI 10.1002/anie.201701895
Quality 36
Reported Formula C19H23NO3
SMILES NC1=C(C(=C(C(=C1OC)C)OC)COC=1C=CC=CC1)CC=C
SPLASH splash10-0006-0900000000-214352357d76c05453c9
Source of Spectrum ACI-56-SM23-S17 (DOI: 10.1002/anie.201701895)
Thin-Layer Chromatography 0.19 (EtOAc/n-hexane, 1:10)
Wiley ID 1895875