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pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline, 5-butyl-8-chloro-1,2,3,4-tetrahydro-
SpectraBase Compound ID BHgrIN2iqfr
InChI InChI=1S/C17H18ClN3S/c1-2-3-8-12-10-6-4-5-7-11(10)13-14-15(22-17(13)21-12)16(18)20-9-19-14/h9H,2-8H2,1H3
InChIKey DNXXGLNTWKKERQ-UHFFFAOYSA-N
Mol Weight 331.87 g/mol
Molecular Formula C17H18ClN3S
Exact Mass 331.090996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Az6tibz9gk
Name pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline, 5-butyl-8-chloro-1,2,3,4-tetrahydro-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H18ClN3S/c1-2-3-8-12-10-6-4-5-7-11(10)13-14-15(22-17(13)21-12)16(18)20-9-19-14/h9H,2-8H2,1H3
InChIKey DNXXGLNTWKKERQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3537
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11278513