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(2'S,1S)-2,3-Dimethyl-1-(4"-azidobutyl)-1-[{(2'-methoxymethyl)pyrrolidinyl}carbonyl]-2,5-cyclohexadiene
SpectraBase Compound ID 5IszdlhAL7s
InChI InChI=1S/C19H30N4O2/c1-15-8-6-11-19(16(15)2,10-4-5-12-21-22-20)18(24)23-13-7-9-17(23)14-25-3/h6,11,17H,4-5,7-10,12-14H2,1-3H3/t17-,19-/m0/s1
InChIKey VCKGENGBECIPOX-HKUYNNGSSA-N
Mol Weight 346.48 g/mol
Molecular Formula C19H30N4O2
Exact Mass 346.236876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpEJBcyNz2P
Name (2'S,1S)-2,3-Dimethyl-1-(4"-azidobutyl)-1-[{(2'-methoxymethyl)pyrrolidinyl}carbonyl]-2,5-cyclohexadiene
Alternate Name(s) ((S)-1-(4-azidobutyl)-2,3-dimethylcyclohexa-2,5-dien-1-yl)((S)-2-(methoxymethyl)pyrrolidin-1-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30N4O2
InChI InChI=1S/C19H30N4O2/c1-15-8-6-11-19(16(15)2,10-4-5-12-21-22-20)18(24)23-13-7-9-17(23)14-25-3/h6,11,17H,4-5,7-10,12-14H2,1-3H3/t17-,19-/m0/s1
InChIKey VCKGENGBECIPOX-HKUYNNGSSA-N
Literature Reference DOI 10.1021/ol8029017
Molecular Weight 346.475 g/mol
SMILES C1C=C[C@@](C(C)=C1C)(C(=O)N1CCC[C@]1(COC)[H])CCCCN=[N+]=[N-]
SPLASH splash10-00dl-8900000000-3a098dfcdadff3aebef9
Source of Spectrum A1-11-963/SMS17-17a
Wiley ID 1756600