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Artavenustine - triacetyl derivative
SpectraBase Compound ID CgwbOZsEoyw
InChI InChI=1S/C24H25NO7/c1-13(26)30-22-8-16-5-6-25-12-18-10-24(32-15(3)28)23(31-14(2)27)9-17(18)7-20(25)19(16)11-21(22)29-4/h8-11,20H,5-7,12H2,1-4H3/t20-/m0/s1
InChIKey DVWNQYHSVGBOFC-FQEVSTJZSA-N
Mol Weight 439.46 g/mol
Molecular Formula C24H25NO7
Exact Mass 439.163102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjjipwU6cam
Name Artavenustine - triacetyl derivative
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25NO7
InChI InChI=1S/C24H25NO7/c1-13(26)30-22-8-16-5-6-25-12-18-10-24(32-15(3)28)23(31-14(2)27)9-17(18)7-20(25)19(16)11-21(22)29-4/h8-11,20H,5-7,12H2,1-4H3/t20-/m0/s1
InChIKey DVWNQYHSVGBOFC-FQEVSTJZSA-N
Molecular Weight 439.464 g/mol
SMILES [C@@]12(N(CCc3cc(c(cc23)OC)OC(=O)C)Cc2c(C1)cc(c(c2)OC(=O)C)OC(=O)C)[H]
SPLASH splash10-002r-0901300000-220e98d142b884d1abc3
Source of Spectrum X2-49-606-12
Wiley ID 1601928