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2-[3-(1H-imidazol-1-yl)propyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione

View entire compound with spectra: 2 NMR

2-[3-(1H-imidazol-1-yl)propyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
SpectraBase Compound ID 1vxClzuBdEq
InChI InChI=1S/C18H15N3O2/c22-17-14-6-1-4-13-5-2-7-15(16(13)14)18(23)21(17)10-3-9-20-11-8-19-12-20/h1-2,4-8,11-12H,3,9-10H2
InChIKey JXIMQXUZTHKDSJ-UHFFFAOYSA-N
Mol Weight 305.34 g/mol
Molecular Formula C18H15N3O2
Exact Mass 305.116427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KDELBpkhup
Name 2-[3-(1H-Imidazol-1-yl)propyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.116426733 u
Formula C18H15N3O2
InChI InChI=1S/C18H15N3O2/c22-17-14-6-1-4-13-5-2-7-15(16(13)14)18(23)21(17)10-3-9-20-11-8-19-12-20/h1-2,4-8,11-12H,3,9-10H2
InChIKey JXIMQXUZTHKDSJ-UHFFFAOYSA-N
Molecular Weight 305.337 g/mol
SMILES C=1C=CC=2C(N(C(C3=CC=CC1C23)=O)CCCN1C=NC=C1)=O