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N-(9'-Deoxycinchonin-9'-yl)isobutyramide
SpectraBase Compound ID 1g5yM2rMD8o
InChI InChI=1S/C23H29N3O/c1-4-16-14-26-12-10-17(16)13-21(26)22(25-23(27)15(2)3)19-9-11-24-20-8-6-5-7-18(19)20/h4-9,11,15-17,21-22H,1,10,12-14H2,2-3H3,(H,25,27)/t16-,17-,21-,22?/m1/s1
InChIKey ICKIFCSUEHYQKB-TYYLEJKGSA-N
Mol Weight 363.51 g/mol
Molecular Formula C23H29N3O
Exact Mass 363.231063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59ADpchRXv2
Name N-(9'-Deoxycinchonin-9'-yl)isobutyramide
Alternate Name(s) N-cinchonan-9-yl-2-methylpropanamide
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Formula C23H29N3O
InChI InChI=1S/C23H29N3O/c1-4-16-14-26-12-10-17(16)13-21(26)22(25-23(27)15(2)3)19-9-11-24-20-8-6-5-7-18(19)20/h4-9,11,15-17,21-22H,1,10,12-14H2,2-3H3,(H,25,27)/t16-,17-,21-,22?/m1/s1
InChIKey ICKIFCSUEHYQKB-TYYLEJKGSA-N
Molecular Weight 363.505 g/mol
SMILES N(C([C@@]1(N2C[C@]([C@@](C1)(CC2)[H])(C=C)[H])[H])c1c2c(cccc2)ncc1)C(=O)C(C)C
SPLASH splash10-01ri-5945000000-c156550b089cf6848336
Source of Spectrum AN-106-82-7
Wiley ID 747647