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N-Cyano-16(R)-cyano-16-decarbomethoxy-19,20(S)-dihydro-15(R)-hydroxyperivine
SpectraBase Compound ID GyJcSsPaxZc
InChI InChI=1S/C20H20N4O2/c1-2-12-10-24(11-22)17-7-14-13-5-3-4-6-16(13)23-19(14)18(25)8-20(12,26)15(17)9-21/h3-6,12,15,17,23,26H,2,7-8,10H2,1H3/t12-,15+,17+,20+/m0/s1
InChIKey PYFIGLKUJRTWBK-GHHTXBMSSA-N
Mol Weight 348.41 g/mol
Molecular Formula C20H20N4O2
Exact Mass 348.158626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCMh6CVj55X
Name N-Cyano-16(R)-cyano-16-decarbomethoxy-19,20(S)-dihydro-15(R)-hydroxyperivine
CAS Registry Number 66140-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N4O2
InChI InChI=1S/C20H20N4O2/c1-2-12-10-24(11-22)17-7-14-13-5-3-4-6-16(13)23-19(14)18(25)8-20(12,26)15(17)9-21/h3-6,12,15,17,23,26H,2,7-8,10H2,1H3/t12-,15+,17+,20+/m0/s1
InChIKey PYFIGLKUJRTWBK-GHHTXBMSSA-N
Molecular Weight 348.406 g/mol
SMILES O[C@]12[C@](CN([C@](Cc3c(C(C2)=O)[nH]c2ccccc32)([C@]1(C#N)[H])[H])C#N)(CC)[H]
SPLASH splash10-0a4j-0905000000-c161712561aeb59aad8e
Source of Spectrum C-100-942-0
Synonyms Vobasan-17,22-dinitrile, 19,20-dihydro-15-hydroxy-3-oxo-, (20.alpha.)- 15-hydroxy-22-nitrilo-3-oxo-19,20-dihydrovobasan-17-nitrile 2,6-Methano-1H-azecino[5,4-b]indole, vobasan-17,22-dinitrile deriv. N-Cyano-16(S)-cyano-16-decarbomethoxy-19,20(S)-dihydro-15(R)-hydroxyperivine
Wiley ID 1340669