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2-(1-adamantyl)-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]acetamide
SpectraBase Compound ID 53pkEY7hodQ
InChI InChI=1S/C22H25Cl2N3O/c23-19-2-1-3-20(24)18(19)13-27-12-17(11-25-27)26-21(28)10-22-7-14-4-15(8-22)6-16(5-14)9-22/h1-3,11-12,14-16H,4-10,13H2,(H,26,28)/t14-,15+,16-,22-
InChIKey BYXQBLRWYKBPAJ-OFWUGVANSA-N
Mol Weight 418.37 g/mol
Molecular Formula C22H25Cl2N3O
Exact Mass 417.137468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLnDJ9wrP8c
Name 2-(1-Adamantyl)-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25Cl2N3O
InChI InChI=1S/C22H25Cl2N3O/c23-19-2-1-3-20(24)18(19)13-27-12-17(11-25-27)26-21(28)10-22-7-14-4-15(8-22)6-16(5-14)9-22/h1-3,11-12,14-16H,4-10,13H2,(H,26,28)/t14-,15+,16-,22-
InChIKey BYXQBLRWYKBPAJ-OFWUGVANSA-N
Molecular Weight 418.368 g/mol
SMILES N(C(=O)CC12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H])c1cn[n](c1)Cc1c(cccc1Cl)Cl
SPLASH splash10-0006-3890000000-b6f3470ac890d7424d32
Synonyms 2-(1-adamantyl)-N-[1-(2,6-dichlorobenzyl)pyrazol-4-yl]acetamide 2-(1-adamantyl)-N-[1-[(2,6-dichlorophenyl)methyl]-4-pyrazolyl]acetamide 2-(1-adamantyl)-N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-4-yl]acetamide 2-(1-adamantyl)-N-[1-[[2,6-bis(chloranyl)phenyl]methyl]pyrazol-4-yl]ethanamide
Wiley ID 1464769