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2-(4-octyl-6-phenyl-[1, 3, 5]triazin-2-ylmethyl)-acrylic acid ethyl ester
SpectraBase Compound ID LlJos8BJ5dk
InChI InChI=1S/C23H31N3O2/c1-4-6-7-8-9-13-16-20-24-21(17-18(3)23(27)28-5-2)26-22(25-20)19-14-11-10-12-15-19/h10-12,14-15H,3-9,13,16-17H2,1-2H3
InChIKey VKDFWLDTHMYOLC-UHFFFAOYSA-N
Mol Weight 381.52 g/mol
Molecular Formula C23H31N3O2
Exact Mass 381.241627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8qbDxcXQ6j
Name 2-(4-octyl-6-phenyl-[1, 3, 5]triazin-2-ylmethyl)-acrylic acid ethyl ester
Alternate Name(s) Ethyl 2-((4-octyl-6-phenyl-1,3,5-triazin-2-yl)methyl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31N3O2
InChI InChI=1S/C23H31N3O2/c1-4-6-7-8-9-13-16-20-24-21(17-18(3)23(27)28-5-2)26-22(25-20)19-14-11-10-12-15-19/h10-12,14-15H,3-9,13,16-17H2,1-2H3
InChIKey VKDFWLDTHMYOLC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol102173z
Molecular Weight 381.520 g/mol
SMILES c1(nc(nc(CC(=C)C(=O)OCC)n1)-c1ccccc1)CCCCCCCC
SPLASH splash10-001i-0192000000-5ad995182be4aa3bb140
Source of Spectrum A1-12-5398/SMS13-5b
Wiley ID 1752652