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3(2H)-Isoxazolone, 2-(1-methylethyl)-4,5-diphenyl-
SpectraBase Compound ID AnsUJalnqmP
InChI InChI=1S/C18H17NO2/c1-13(2)19-18(20)16(14-9-5-3-6-10-14)17(21-19)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey SKFHWMWSEBHDAI-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQvC0XbSoES
Name 3(2H)-Isoxazolone, 2-(1-methylethyl)-4,5-diphenyl-
Alternate Name(s) 2-isoPropyl-4,5-diphenylisoxazol-3(2H)-one 4,5-Diphenyl-2-isopropyl-3(2H)-isoxazolone
CAS Registry Number 112175-86-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-13(2)19-18(20)16(14-9-5-3-6-10-14)17(21-19)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey SKFHWMWSEBHDAI-UHFFFAOYSA-N
Molecular Weight 279.339 g/mol
SMILES C=1(C(N(C(C)C)OC1c1ccccc1)=O)c1ccccc1
SPLASH splash10-004i-3190000000-7a9cb8a5d3d7bda05efe
Source of Spectrum KC-1987-964-6
Wiley ID 1283173