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6H-pyrimido[4',5':4,5]pyrrolo[1,2-a]azepine-11-carbonitrile, 4-(ethylthio)-7,8,9,10-tetrahydro-
SpectraBase Compound ID BjJsiHOI1HK
InChI InChI=1S/C14H16N4S/c1-2-19-14-13-12(16-9-17-14)10(8-15)11-6-4-3-5-7-18(11)13/h9H,2-7H2,1H3
InChIKey NDBXVQAMIDSESR-UHFFFAOYSA-N
Mol Weight 272.37 g/mol
Molecular Formula C14H16N4S
Exact Mass 272.109568 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID In0qcD4mw6m
Name 6H-pyrimido[4',5':4,5]pyrrolo[1,2-a]azepine-11-carbonitrile, 4-(ethylthio)-7,8,9,10-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/C14H16N4S/c1-2-19-14-13-12(16-9-17-14)10(8-15)11-6-4-3-5-7-18(11)13/h9H,2-7H2,1H3
InChIKey NDBXVQAMIDSESR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6458
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/10266665