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Ajmaline-M (nor-) 3AC
SpectraBase Compound ID HdM9rsdCkVR
InChI InChI=1S/C25H30N2O5/c1-5-15-16-10-19-22-25(17-8-6-7-9-18(17)26(22)12(2)28)11-20(21(16)23(25)31-13(3)29)27(19)24(15)32-14(4)30/h6-9,15-16,19-24H,5,10-11H2,1-4H3/t15?,16-,19+,20+,21-,22?,23-,24?,25+/m0/s1
InChIKey KRFLHCYRCOUVOX-ZJYVSZLQSA-N
Mol Weight 438.52 g/mol
Molecular Formula C25H30N2O5
Exact Mass 438.215472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FO81KczK2a6
Name 17,21-Triacetylnorajmaline
Alternate Name(s) 8-Acetyl-14-(acetyloxy)-13-ethyl-8,15-diazahexacyclo[14.2.1.0(1,9).0(2,7).0(10,15).0(12,17)]nonadeca-2,4,6-trien-18-yl acetate
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Formula C25H30N2O5
InChI InChI=1S/C25H30N2O5/c1-5-15-16-10-19-22-25(17-8-6-7-9-18(17)26(22)12(2)28)11-20(21(16)23(25)31-13(3)29)27(19)24(15)32-14(4)30/h6-9,15-16,19-24H,5,10-11H2,1-4H3/t15?,16-,19+,20+,21-,22?,23-,24?,25+/m0/s1
InChIKey KRFLHCYRCOUVOX-ZJYVSZLQSA-N
Molecular Weight 438.524 g/mol
SMILES [C@@]123C(N(C(=O)C)c4c3cccc4)[C@]3(C[C@@]4([C@]([C@@]2(OC(=O)C)[H])([C@](N3C(OC(=O)C)C4CC)(C1)[H])[H])[H])[H]
SPLASH splash10-00l2-0945000000-cc3260334c496cdbca78
Source of Spectrum CJ-0-0-0
Wiley ID 1384182