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(1-S,3-S,4-R,7-S,8-S,11-S,12-S,13-S,15-R,20-R)-7,20-DIFORMAMIDOISOCYCLOAMPHILECTANE
SpectraBase Compound ID KMIQl3ifp3u
InChI InChI=1S/C22H36N2O2/c1-13-9-15-10-14(2)22(4,24-12-26)18-6-5-17-20(19(15)18)16(13)7-8-21(17,3)23-11-25/h11-20H,5-10H2,1-4H3,(H,23,25)(H,24,26)/t13-,14+,15-,16+,17-,18-,19+,20+,21-,22+/m0/s1
InChIKey SJUBXKFUQQKUEC-OXEUSEQRSA-N
Mol Weight 360.5 g/mol
Molecular Formula C22H36N2O2
Exact Mass 360.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hNv11tL8w9
Name (1S,3S,4R,7S,8S,11S,12S,13S,15R,20R)-7,20-bis(Formamido)-isocycloamphilectane
Alternate Name(s) N-[(1S,3aR,4S,5aS,7R,8R,8aS,10aS,10bS,10cS)-8-formamido-1,4,7,8-tetramethyl-2,3,3a,4,5,5a,6,7,8a,9,10,10a,10b,10c-tetradecahydropyren-1-yl]methanamide
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Formula C22H36N2O2
InChI InChI=1S/C22H36N2O2/c1-13-9-15-10-14(2)22(4,24-12-26)18-6-5-17-20(19(15)18)16(13)7-8-21(17,3)23-11-25/h11-20H,5-10H2,1-4H3,(H,23,25)(H,24,26)/t13-,14+,15-,16+,17-,18-,19+,20+,21-,22+/m0/s1
InChIKey SJUBXKFUQQKUEC-OXEUSEQRSA-N
Molecular Weight 360.542 g/mol
SMILES N(C=O)[C@@]1([C@@]2([C@@]3([C@]4([C@@]([C@@]([C@@](C[C@@]4(C[C@@]([C@]3(CC1)[H])(C)[H])[H])(C)[H])(NC=O)C)(CC2)[H])[H])[H])[H])C
SPLASH splash10-00di-0094000000-2de5cba82e698beece9a
Source of Spectrum G4-72-495-2
Wiley ID 1702073