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2,2,2-trifluoroethyl 2-[2-(1-adamantyloxy)ethylcarbamoyl]cyclohexane-1-carboxylate
SpectraBase Compound ID 4Tw7DfmnBP2
InChI InChI=1S/C22H32F3NO4/c23-22(24,25)13-29-20(28)18-4-2-1-3-17(18)19(27)26-5-6-30-21-10-14-7-15(11-21)9-16(8-14)12-21/h14-18H,1-13H2,(H,26,27)/t14-,15+,16-,17?,18?,21-
InChIKey OXHIKTRZTJORNN-UAVDWYRKSA-N
Mol Weight 431.5 g/mol
Molecular Formula C22H32F3NO4
Exact Mass 431.228343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Nm7RTfQRKC
Name 2,2,2-trifluoroethyl 2-[2-(1-adamantyloxy)ethylcarbamoyl]cyclohexane-1-carboxylate
Alternate Name(s) 2,2,2-trifluoroethyl 2-[2-(1-adamantyloxy)ethylcarbamoyl]cyclohexanecarboxylate 2,2,2-tris(fluoranyl)ethyl 2-[2-(1-adamantyloxy)ethylcarbamoyl]cyclohexane-1-carboxylate 2-[2-(1-adamantyloxy)ethylcarbamoyl]cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester 2-[[2-(1-adamantyloxy)ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester
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Formula C22H32F3NO4
InChI InChI=1S/C22H32F3NO4/c23-22(24,25)13-29-20(28)18-4-2-1-3-17(18)19(27)26-5-6-30-21-10-14-7-15(11-21)9-16(8-14)12-21/h14-18H,1-13H2,(H,26,27)/t14-,15+,16-,17?,18?,21-
InChIKey OXHIKTRZTJORNN-UAVDWYRKSA-N
Molecular Weight 431.496 g/mol
SMILES N(C(=O)C1C(CCCC1)C(OCC(F)(F)F)=O)CCOC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-000i-7940000000-3cf4dd17f72d4492b511
Wiley ID 1445601