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(5-tert-butyl-2-methyl-3-furanyl)-[4-(2-chloro-4-nitrophenyl)-2-methyl-1-piperazinyl]methanone
SpectraBase Compound ID CjtXAZZezWE
InChI InChI=1S/C21H26ClN3O4/c1-13-12-23(18-7-6-15(25(27)28)10-17(18)22)8-9-24(13)20(26)16-11-19(21(3,4)5)29-14(16)2/h6-7,10-11,13H,8-9,12H2,1-5H3
InChIKey ZHRRUBWGGTYGFK-UHFFFAOYSA-N
Mol Weight 419.91 g/mol
Molecular Formula C21H26ClN3O4
Exact Mass 419.161184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SduRQNi9Xo
Name (5-tert-butyl-2-methyl-3-furanyl)-[4-(2-chloro-4-nitrophenyl)-2-methyl-1-piperazinyl]methanone
Alternate Name(s) (5-tert-butyl-2-methyl-3-furyl)-[4-(2-chloro-4-nitro-phenyl)-2-methyl-piperazin-1-yl]methanone (5-tert-butyl-2-methyl-3-furyl)-[4-(2-chloro-4-nitro-phenyl)-2-methyl-piperazino]methanone (5-tert-butyl-2-methyl-furan-3-yl)-[4-(2-chloranyl-4-nitro-phenyl)-2-methyl-piperazin-1-yl]methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26ClN3O4
InChI InChI=1S/C21H26ClN3O4/c1-13-12-23(18-7-6-15(25(27)28)10-17(18)22)8-9-24(13)20(26)16-11-19(21(3,4)5)29-14(16)2/h6-7,10-11,13H,8-9,12H2,1-5H3
InChIKey ZHRRUBWGGTYGFK-UHFFFAOYSA-N
Molecular Weight 419.909 g/mol
SMILES CC(C)(C)c1cc(C(N2C(CN(CC2)c2ccc(cc2Cl)N(=O)=O)C)=O)c(o1)C
SPLASH splash10-01b9-4970100000-10d0661574c907b1da53
Wiley ID 1446555