For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-Benzyl-2-[(4-hydroxybenzyl)amido]-5-(3-fluoro-4-hydroxyphenyl)pyrazin
SpectraBase Compound ID B5kquyNGLVh
InChI InChI=1S/C25H20FN3O3/c26-20-14-18(8-11-23(20)31)22-15-27-25(21(28-22)12-16-4-2-1-3-5-16)29-24(32)13-17-6-9-19(30)10-7-17/h1-11,14-15,30-31H,12-13H2,(H,27,29,32)
InChIKey CQYLFXRYKRKLOT-UHFFFAOYSA-N
Mol Weight 429.45 g/mol
Molecular Formula C25H20FN3O3
Exact Mass 429.14887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID L5dDFVrcrZb
Name 3-Benzyl-2-[(4-hydroxybenzyl)amido]-5-(3-fluoro-4-hydroxyphenyl)pyrazin
Alternate Name(s) 3-Benzyl-2-[(4-hydroxybenzyl)amido]-5-(3-fluoro-4-hydroxyphenyl)pyrazin-3-one N-[3-benzyl-5-(3-fluoro-4-hydroxyphenyl)-2-pyrazinyl]-2-(4-hydroxyphenyl)acetamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20FN3O3
InChI InChI=1S/C25H20FN3O3/c26-20-14-18(8-11-23(20)31)22-15-27-25(21(28-22)12-16-4-2-1-3-5-16)29-24(32)13-17-6-9-19(30)10-7-17/h1-11,14-15,30-31H,12-13H2,(H,27,29,32)
InChIKey CQYLFXRYKRKLOT-UHFFFAOYSA-N
Molecular Weight 429.451 g/mol
SMILES N(c1c(nc(-c2ccc(c(c2)F)O)cn1)Cc1ccccc1)C(Cc1ccc(cc1)O)=O
SPLASH splash10-002b-0090700000-2991e440c4be8aee830d
Source of Spectrum AT-39-5544-2
Wiley ID 854232