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8-Isoquinolinol, 1-[(3-aminophenyl)methyl]-7-methoxy-
SpectraBase Compound ID 6hohm3ek6W1
InChI InChI=1S/C17H16N2O2/c1-21-15-6-5-12-7-8-19-14(16(12)17(15)20)10-11-3-2-4-13(18)9-11/h2-9,20H,10,18H2,1H3
InChIKey PWLRFXVCGZAHIJ-UHFFFAOYSA-N
Mol Weight 280.33 g/mol
Molecular Formula C17H16N2O2
Exact Mass 280.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUATCCgIU6F
Name 8-Isoquinolinol, 1-[(3-aminophenyl)methyl]-7-methoxy-
Alternate Name(s) 1-(3'-Aminobenzyl)-7-methoxyisoquinolin-8-ol 1-(3-aminobenzyl)-7-methoxy-8-isoquinolinol
CAS Registry Number 113756-81-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O2
InChI InChI=1S/C17H16N2O2/c1-21-15-6-5-12-7-8-19-14(16(12)17(15)20)10-11-3-2-4-13(18)9-11/h2-9,20H,10,18H2,1H3
InChIKey PWLRFXVCGZAHIJ-UHFFFAOYSA-N
Molecular Weight 280.327 g/mol
SMILES Oc1c2c(Cc3cc(ccc3)N)nccc2ccc1OC
SPLASH splash10-01q9-0090000000-4c9aa70e22d415a5ffb4
Source of Spectrum Y-24-618-9
Wiley ID 1284114