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KOPSOFINONE
SpectraBase Compound ID 3C2k5WZLeHP
InChI InChI=1S/C22H24N2O6/c1-28-18(26)22(27)17(25)19-5-2-9-24-10-8-20(16(19)24)12-3-4-13-15(30-11-29-13)14(12)23-21(20,22)7-6-19/h3-4,16,23,27H,2,5-11H2,1H3/t16-,19-,20+,21-,22+/m0/s1
InChIKey JVVDRTHBTYJZSQ-GSNCRSPSSA-N
Mol Weight 412.44 g/mol
Molecular Formula C22H24N2O6
Exact Mass 412.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4I9gMMpYEwU
Name Kopsifinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O6
InChI InChI=1S/C22H24N2O6/c1-28-18(26)22(27)17(25)19-5-2-9-24-10-8-20(16(19)24)12-3-4-13-15(30-11-29-13)14(12)23-21(20,22)7-6-19/h3-4,16,23,27H,2,5-11H2,1H3/t16-,19-,20+,21-,22+/m0/s1
InChIKey JVVDRTHBTYJZSQ-GSNCRSPSSA-N
Molecular Weight 412.442 g/mol
SMILES O[C@]1(C([C@]23CCCN4[C@@]2([C@@]2([C@]1(CC3)Nc1c3c(ccc21)OCO3)CC4)[H])=O)C(=O)OC
SPLASH splash10-03xr-0539800000-38f9376d88151d3aead2
Source of Spectrum G4-71-57-7
Wiley ID 1695279