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N-[1-[1-(1-adamantyl)propyl]-2,5-bis(oxidanylidene)-4-(trifluoromethyl)imidazolidin-4-yl]-3-methyl-benzamide
SpectraBase Compound ID HLJOJEwJEjb
InChI InChI=1S/C25H30F3N3O3/c1-3-19(23-11-15-8-16(12-23)10-17(9-15)13-23)31-21(33)24(25(26,27)28,30-22(31)34)29-20(32)18-6-4-5-14(2)7-18/h4-7,15-17,19H,3,8-13H2,1-2H3,(H,29,32)(H,30,34)/t15-,16+,17-,19?,23-,24?
InChIKey AUUPWPCQLNJAKR-AGSFKFAHSA-N
Mol Weight 477.53 g/mol
Molecular Formula C25H30F3N3O3
Exact Mass 477.223926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ylvvU2e2xP
Name N-[1-[1-(1-adamantyl)propyl]-2,5-bis(oxidanylidene)-4-(trifluoromethyl)imidazolidin-4-yl]-3-methyl-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30F3N3O3
InChI InChI=1S/C25H30F3N3O3/c1-3-19(23-11-15-8-16(12-23)10-17(9-15)13-23)31-21(33)24(25(26,27)28,30-22(31)34)29-20(32)18-6-4-5-14(2)7-18/h4-7,15-17,19H,3,8-13H2,1-2H3,(H,29,32)(H,30,34)/t15-,16+,17-,19?,23-,24?
InChIKey AUUPWPCQLNJAKR-AGSFKFAHSA-N
Molecular Weight 477.528 g/mol
SMILES N1C(N(C(C1(NC(c1cc(ccc1)C)=O)C(F)(F)F)=O)C(C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])CC)=O
SPLASH splash10-000l-6901000000-5c07fb9cf2fb6d7439bb
Synonyms N-[1-[1-(1-adamantyl)propyl]-2,5-diketo-4-(trifluoromethyl)imidazolidin-4-yl]-3-methyl-benzamide N-[1-[1-(1-adamantyl)propyl]-2,5-dioxo-4-(trifluoromethyl)-4-imidazolidinyl]-3-methylbenzamide N-[1-[1-(1-adamantyl)propyl]-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-3-methyl-benzamide
Wiley ID 1443202