For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

methyl 2-({[(1R,9R)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]carbothioyl}amino)propanoate

Compound with spectra: 1 NMR

methyl 2-({[(1R,9R)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]carbothioyl}amino)propanoate
SpectraBase Compound ID Af3BKOLqCvd
InChI InChI=1S/C16H21N3O3S/c1-10(15(21)22-2)17-16(23)18-7-11-6-12(9-18)13-4-3-5-14(20)19(13)8-11/h3-5,10-12H,6-9H2,1-2H3,(H,17,23)
InChIKey ZWQKNNFOAUQNLS-UHFFFAOYSA-N
Mol Weight 335.42 g/mol
Molecular Formula C16H21N3O3S
Exact Mass 335.130363 g/mol

View Spectrum of methyl 2-({[(1R,9R)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]carbothioyl}amino)propanoate

1H NMR Spectrum
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6
  • methyl 2-({[6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]carbothioyl}amino)propanoate
(1R,5S)-8-Oxo-N-{2-[1-(prop-2-yn-1-yloxy)-ethoxy]ethyl}-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido[1,2-a][1,5]diazocine-3-carbothioamide
(1R,5R)-8-oxo-N-(pyridin-3-yl)-4,5,6,8-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(2H)-carbothioamide
(S)-4-(methylthio)-2-((1R,5R)-8-oxo-2,3,4,5,6,8-hexahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocine-3-carboxamido)butanoic acid
(1R,9R)-N-(4-fluorophenyl)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-diene-11-carboxamide
3-(2-Amino-3-phenyl-propionyl)-1,2,3,4,5,6-hexahydro-1,5-methano-pyrido[1,2-a][1,5]diazocin-8-one
1H-Pyrido[3,4,5-a,b]quinolizin-6-one, 2,3,3a,4,6,9b-hexahydro-2-(2-hydroxy-1-oxo-2-phenyl)-
Pyrido[1,2-a][1,5]diazocin-8-one, 3-[3-(3,4-dimethoxyphenyl)acryloyl]-1,2,3,4,5,6-hexahydro-1,5-methano-
Cytisine PFP
1H-Pyrido[3,4,5-a,b]quinolizin-6-one, 2,3,3a,4,6,9b-hexahydro-2-(2,2-dimethyl-4-oxanylcarbonyl)-
3-[4,6-bis-(4-methyl-piperidin-1-yl)-[1,3,5]triazin-2-yl]-1,2,3,4,5,6-hexahydro-1,5-methano-pyrido[1,2-a][1,5]diazocin-8-one
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.