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Ceratocapnine
SpectraBase Compound ID 1E4sb7aRPge
InChI InChI=1S/C22H25NO7/c1-6-29-22(25)14-8-10-16(27-4)20(28-5)18(14)30-19-15(26-3)9-7-13-11-12-23(2)21(24)17(13)19/h7-10H,6,11-12H2,1-5H3
InChIKey LRJYAIRIBZOBSJ-UHFFFAOYSA-N
Mol Weight 415.44 g/mol
Molecular Formula C22H25NO7
Exact Mass 415.163102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ef88ROlY5sd
Name Ceratocapnine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO7
InChI InChI=1S/C22H25NO7/c1-6-29-22(25)14-8-10-16(27-4)20(28-5)18(14)30-19-15(26-3)9-7-13-11-12-23(2)21(24)17(13)19/h7-10H,6,11-12H2,1-5H3
InChIKey LRJYAIRIBZOBSJ-UHFFFAOYSA-N
Molecular Weight 415.442 g/mol
SMILES c12C(N(C)CCc2ccc(c1Oc1c(C(=O)OCC)ccc(c1OC)OC)OC)=O
SPLASH splash10-014i-0114900000-2955c5ff3dfe59f08a0c
Source of Spectrum X2-53-1008-3
Wiley ID 1603679