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N-[1-[1-(1-adamantyl)propyl]-2,5-bis(oxidanylidene)-4-(trifluoromethyl)imidazolidin-4-yl]-4-methoxy-benzamide
SpectraBase Compound ID ide8UQGNPN
InChI InChI=1S/C25H30F3N3O4/c1-3-19(23-11-14-8-15(12-23)10-16(9-14)13-23)31-21(33)24(25(26,27)28,30-22(31)34)29-20(32)17-4-6-18(35-2)7-5-17/h4-7,14-16,19H,3,8-13H2,1-2H3,(H,29,32)(H,30,34)/t14-,15+,16-,19?,23-,24?
InChIKey FCNWCWMJZWPSSC-HJMAEZKYSA-N
Mol Weight 493.53 g/mol
Molecular Formula C25H30F3N3O4
Exact Mass 493.218841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRLLF2VOcb2
Name N-[1-[1-(1-adamantyl)propyl]-2,5-bis(oxidanylidene)-4-(trifluoromethyl)imidazolidin-4-yl]-4-methoxy-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30F3N3O4
InChI InChI=1S/C25H30F3N3O4/c1-3-19(23-11-14-8-15(12-23)10-16(9-14)13-23)31-21(33)24(25(26,27)28,30-22(31)34)29-20(32)17-4-6-18(35-2)7-5-17/h4-7,14-16,19H,3,8-13H2,1-2H3,(H,29,32)(H,30,34)/t14-,15+,16-,19?,23-,24?
InChIKey FCNWCWMJZWPSSC-HJMAEZKYSA-N
Molecular Weight 493.527 g/mol
SMILES N1C(N(C(C1(NC(c1ccc(cc1)OC)=O)C(F)(F)F)=O)C(C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])CC)=O
SPLASH splash10-000i-3900000000-21c75b93223e82099325
Synonyms N-[1-[1-(1-adamantyl)propyl]-2,5-diketo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methoxy-benzamide N-[1-[1-(1-adamantyl)propyl]-2,5-dioxo-4-(trifluoromethyl)-4-imidazolidinyl]-4-methoxybenzamide N-[1-[1-(1-adamantyl)propyl]-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methoxy-benzamide
Wiley ID 1443112