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3.alpha.-cyano-10-methoxy-C(4)-norquebrachamine 5(.alpha.)
SpectraBase Compound ID EtzrIU24GnO
InChI InChI=1S/C20H25N3O/c1-3-20-9-5-10-23(13-20)11-8-15-14-6-4-7-17(24-2)19(14)22-18(15)16(20)12-21/h4,6-7,16,22H,3,5,8-11,13H2,1-2H3/t16-,20-/m1/s1
InChIKey SCJQGTQCTQNBFT-OXQOHEQNSA-N
Mol Weight 323.44 g/mol
Molecular Formula C20H25N3O
Exact Mass 323.199762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ByaYhRT1iIj
Name 3.alpha.-cyano-10-methoxy-C(4)-norquebrachamine 5(.alpha.)
Alternate Name(s) (1S,2S)-1-ethyl-6-methoxy-4,14-diazatetracyclo[12.3.1.0(3,11).0(5,10)]octadeca-3(11),5,7,9-tetraene-2-carbonitrile
CAS Registry Number 111324-85-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25N3O
InChI InChI=1S/C20H25N3O/c1-3-20-9-5-10-23(13-20)11-8-15-14-6-4-7-17(24-2)19(14)22-18(15)16(20)12-21/h4,6-7,16,22H,3,5,8-11,13H2,1-2H3/t16-,20-/m1/s1
InChIKey SCJQGTQCTQNBFT-OXQOHEQNSA-N
Molecular Weight 323.440 g/mol
SMILES [nH]1c2c(cccc2c2c1[C@]([C@]1(CN(CC2)CCC1)CC)(C#N)[H])OC
SPLASH splash10-01t9-1901000000-cdee14e024cb22eead35
Source of Spectrum J-53-44-10
Wiley ID 1322617