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1-Butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline

View entire compound with spectra: 1 MS (GC)

1-Butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline
SpectraBase Compound ID 56eWYisEmwn
InChI InChI=1S/C19H19N3O5/c1-2-3-12-27-19-16-7-5-4-6-14(16)10-11-20(19)17-9-8-15(21(23)24)13-18(17)22(25)26/h4-11,13,19H,2-3,12H2,1H3
InChIKey FDUOSGOTTBUSER-UHFFFAOYSA-N
Mol Weight 369.38 g/mol
Molecular Formula C19H19N3O5
Exact Mass 369.132471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XJDVszLDYl
Name 1-Butoxy-2-(2,4-dinitrophenyl)-1H-isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19N3O5
InChI InChI=1S/C19H19N3O5/c1-2-3-12-27-19-16-7-5-4-6-14(16)10-11-20(19)17-9-8-15(21(23)24)13-18(17)22(25)26/h4-11,13,19H,2-3,12H2,1H3
InChIKey FDUOSGOTTBUSER-UHFFFAOYSA-N
Molecular Weight 369.377 g/mol
SMILES c1(N2C(c3ccccc3C=C2)OCCCC)c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-000i-0091000000-d617cae460a788d48586
Source of Spectrum J-61-9597-8
Wiley ID 1353601