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1-[2-(4-chlorophenyl)-3-(4-morpholinophenyl)-4-p-phenetyl-3H-1,2,4-triazol-5-yl]ethanone

View entire compound with spectra: 1 MS (GC)

1-[2-(4-chlorophenyl)-3-(4-morpholinophenyl)-4-p-phenetyl-3H-1,2,4-triazol-5-yl]ethanone
SpectraBase Compound ID 8ql5Bh5IJlE
InChI InChI=1S/C28H29ClN4O3/c1-3-36-26-14-12-24(13-15-26)32-27(20(2)34)30-33(25-10-6-22(29)7-11-25)28(32)21-4-8-23(9-5-21)31-16-18-35-19-17-31/h4-15,28H,3,16-19H2,1-2H3
InChIKey MLTDXCWWYJXGBW-UHFFFAOYSA-N
Mol Weight 505.02 g/mol
Molecular Formula C28H29ClN4O3
Exact Mass 504.192819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vSMRfeluy3
Name 1-[2-(4-chlorophenyl)-3-(4-morpholinophenyl)-4-p-phenetyl-3H-1,2,4-triazol-5-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29ClN4O3
InChI InChI=1S/C28H29ClN4O3/c1-3-36-26-14-12-24(13-15-26)32-27(20(2)34)30-33(25-10-6-22(29)7-11-25)28(32)21-4-8-23(9-5-21)31-16-18-35-19-17-31/h4-15,28H,3,16-19H2,1-2H3
InChIKey MLTDXCWWYJXGBW-UHFFFAOYSA-N
Molecular Weight 505.018 g/mol
SMILES CCOc1ccc(N2C(=NN(C2c2ccc(N3CCOCC3)cc2)c2ccc(cc2)Cl)C(=O)C)cc1
SPLASH splash10-0f6x-4779040000-cd64c5254c8b6f3509bd
Synonyms 1-[2-(4-chlorophenyl)-4-(4-ethoxyphenyl)-3-(4-morpholin-4-ylphenyl)-3H-1,2,4-triazol-5-yl]ethanone 1-[2-(4-chlorophenyl)-4-(4-ethoxyphenyl)-3-(4-morpholinophenyl)-3H-1,2,4-triazol-5-yl]ethanone 1-[2-(4-chlorophenyl)-4-(4-ethoxyphenyl)-3-[4-(4-morpholinyl)phenyl]-3H-1,2,4-triazol-5-yl]ethanone
Wiley ID 1437383