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1,14-Diacetoxy-8-dehydroxy-16,17-dehydro-16-demethoxyisotalatizidine
SpectraBase Compound ID AGNaV02vXUQ
InChI InChI=1S/C26H37NO5/c1-5-27-13-25(15-30-4)11-10-22(31-16(2)28)26(14-27)20-12-19-7-6-18(8-9-21(25)26)23(20)24(19)32-17(3)29/h6-8,19-24H,5,9-15H2,1-4H3/t19?,20?,21?,22-,23?,24-,25?,26?/m0/s1
InChIKey JJHQKYPROSSBSJ-ONCWUPAOSA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO5
Exact Mass 443.267173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HC1ENJqAoUs
Name 1,14-Diacetoxy-8-dehydroxy-16,17-dehydro-16-demethoxyisotalatizidine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO5
InChI InChI=1S/C26H37NO5/c1-5-27-13-25(15-30-4)11-10-22(31-16(2)28)26(14-27)20-12-19-7-6-18(8-9-21(25)26)23(20)24(19)32-17(3)29/h6-8,19-24H,5,9-15H2,1-4H3/t19?,20?,21?,22-,23?,24-,25?,26?/m0/s1
InChIKey JJHQKYPROSSBSJ-ONCWUPAOSA-N
Molecular Weight 443.584 g/mol
SMILES C123C4C5[C@@](OC(=O)C)(C(C4)C=CC5=CCC1C(COC)(CN(C2)CC)CC[C@@]3(OC(=O)C)[H])[H]
SPLASH splash10-0udi-0000900000-274e6b989befa3093acd
Source of Spectrum E2-48-1916-15
Wiley ID 1555491