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O-Propionyl-N-benzylnorcaryachine
SpectraBase Compound ID H6PPLy0nnHC
InChI InChI=1S/C28H27NO5/c1-3-28(30)34-27-14-21-18(11-24(27)31-2)9-22-20-13-26-25(32-16-33-26)12-19(20)10-23(21)29(22)15-17-7-5-4-6-8-17/h4-8,11-14,22-23H,3,9-10,15-16H2,1-2H3/t22-,23-/m1/s1
InChIKey QYDSRCWEETUYLX-DHIUTWEWSA-N
Mol Weight 457.53 g/mol
Molecular Formula C28H27NO5
Exact Mass 457.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GXI6oRyezG
Name O-Propionyl-N-benzylnorcaryachine
Alternate Name(s) 20-benzyl-16-methoxy-5,7-dioxa-20-azapentacyclo[10.7.1.0(2,10).0(4,8).0(13,18)]icosa-2(10),3,8,13,15,17-hexaen-15-yl propionate O-Propionyl-N-abenzylcaryachine
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Formula C28H27NO5
InChI InChI=1S/C28H27NO5/c1-3-28(30)34-27-14-21-18(11-24(27)31-2)9-22-20-13-26-25(32-16-33-26)12-19(20)10-23(21)29(22)15-17-7-5-4-6-8-17/h4-8,11-14,22-23H,3,9-10,15-16H2,1-2H3/t22-,23-/m1/s1
InChIKey QYDSRCWEETUYLX-DHIUTWEWSA-N
Molecular Weight 457.526 g/mol
SMILES [C@]12(N([C@](Cc3cc4OCOc4cc23)(c2c(cc(c(c2)OC(=O)CC)OC)C1)[H])Cc1ccccc1)[H]
SPLASH splash10-08fu-8092500000-5733096318da77b5059e
Source of Spectrum H1-43-1413-6
Wiley ID 757913