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9-chloro-3-[3-(1H-imidazol-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

View entire compound with spectra: 1 NMR

9-chloro-3-[3-(1H-imidazol-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
SpectraBase Compound ID DOjxz0gyTtb
InChI InChI=1S/C16H14ClN5O/c17-11-3-1-4-12-13(11)14-15(20-12)16(23)22(10-19-14)7-2-6-21-8-5-18-9-21/h1,3-5,8-10,20H,2,6-7H2
InChIKey CFMHRMIKRLXAHN-UHFFFAOYSA-N
Mol Weight 327.78 g/mol
Molecular Formula C16H14ClN5O
Exact Mass 327.088688 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HIwq8oWYbY
Name 9-chloro-3-[3-(1H-imidazol-1-yl)propyl]-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/C16H14ClN5O/c17-11-3-1-4-12-13(11)14-15(20-12)16(23)22(10-19-14)7-2-6-21-8-5-18-9-21/h1,3-5,8-10,20H,2,6-7H2
InChIKey CFMHRMIKRLXAHN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3915
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: D99965; Labnumber: SIMAK-02004; SBI_ID: SBI-003917
Temperature 315 °C