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3-Benzyloxy-2-methyl-1-(2'-phenylethyl)-4-[(2'-acetamido)ethylamino]pyridinium tetrafluoroborate
SpectraBase Compound ID Gmu4RQyqHfW
InChI InChI=1S/C25H29N3O2.BF4/c1-20-25(30-19-23-11-7-4-8-12-23)24(27-16-15-26-21(2)29)14-18-28(20)17-13-22-9-5-3-6-10-22;2-1(3,4)5/h3-12,14,18H,13,15-17,19H2,1-2H3,(H,26,29);/q;-1/p+1
InChIKey WQOKXRHQRUDTCI-UHFFFAOYSA-O
Mol Weight 491.34 g/mol
Molecular Formula C25H30BF4N3O2
Exact Mass 491.23672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jddg0CfYDHo
Name 3-Benzyloxy-2-methyl-1-(2'-phenylethyl)-4-[(2'-acetamido)ethylamino]pyridinium tetrafluoroborate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30BF4N3O2
InChI InChI=1S/C25H29N3O2.BF4/c1-20-25(30-19-23-11-7-4-8-12-23)24(27-16-15-26-21(2)29)14-18-28(20)17-13-22-9-5-3-6-10-22;2-1(3,4)5/h3-12,14,18H,13,15-17,19H2,1-2H3,(H,26,29);/q;-1/p+1
InChIKey WQOKXRHQRUDTCI-UHFFFAOYSA-O
Molecular Weight 491.338 g/mol
SMILES [B-](F)(F)(F)F.N(c1c(c([n+](cc1)CCc1ccccc1)C)OCc1ccccc1)CCNC(=O)C
SPLASH splash10-05mo-9411000000-04f11da0484117b4185d
Source of Spectrum Y-31-952-4
Synonyms 4-{[2-(acetylamino)ethyl]amino}-3-(benzyloxy)-2-methyl-1-(2-phenylethyl)pyridinium tetrafluoroborate N-[2-[(2-methyl-1-phenethyl-3-phenylmethoxy-4-pyridin-1-iumyl)amino]ethyl]acetamide tetrafluoroborate N-[2-[(2-methyl-1-phenethyl-3-phenylmethoxy-pyridin-1-ium-4-yl)amino]ethyl]ethanamide tetrafluoroborate N-[2-[(2-methyl-1-phenethyl-3-phenylmethoxypyridin-1-ium-4-yl)amino]ethyl]acetamide tetrafluoroborate N-[2-[(3-benzoxy-2-methyl-1-phenethyl-pyridin-1-ium-4-yl)amino]ethyl]acetamide tetrafluoroborate N-[2-[(3-benzyloxy-2-methyl-1-phenethyl-pyridin-1-ium-4-yl)amino]ethyl]acetamide tetrafluoroborate N-[2-[[2-methyl-1-(2-phenylethyl)-3-phenylmethoxy-4-pyridin-1-iumyl]amino]ethyl]acetamide;tetrafluoroborate N-[2-[[2-methyl-1-(2-phenylethyl)-3-phenylmethoxypyridin-1-ium-4-yl]amino]ethyl]acetamide;tetrafluoroborate N-[2-[[3-benzyloxy-2-methyl-1-(2-phenylethyl)pyridin-1-ium-4-yl]amino]ethyl]acetamide;tetrafluoroborate N-[2-[[2-methyl-1-(2-phenylethyl)-3-phenylmethoxy-pyridin-1-ium-4-yl]amino]ethyl]ethanamide;tetrafluoroborate
Wiley ID 761479