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9-chloro-3-isopentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

View entire compound with spectra: 1 NMR

9-chloro-3-isopentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
SpectraBase Compound ID FxbAp6nWKUg
InChI InChI=1S/C15H16ClN3O/c1-9(2)6-7-19-8-17-13-12-10(16)4-3-5-11(12)18-14(13)15(19)20/h3-5,8-9,18H,6-7H2,1-2H3
InChIKey XHECOMZJEPGRGE-UHFFFAOYSA-N
Mol Weight 289.77 g/mol
Molecular Formula C15H16ClN3O
Exact Mass 289.09819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LCNf3fGKVUh
Name 9-chloro-3-isopentyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
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/C15H16ClN3O/c1-9(2)6-7-19-8-17-13-12-10(16)4-3-5-11(12)18-14(13)15(19)20/h3-5,8-9,18H,6-7H2,1-2H3
InChIKey XHECOMZJEPGRGE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3966
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: E00050; Labnumber: SIMAK-02088; SBI_ID: SBI-003968
Temperature 318 °C