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Dihydroalangimarine
SpectraBase Compound ID CaJFxVfxaSQ
InChI InChI=1S/C19H18N2O3/c1-3-11-9-20-10-15-13(11)7-16-14-8-17(22)18(24-2)6-12(14)4-5-21(16)19(15)23/h6-10,22H,3-5H2,1-2H3
InChIKey NKRQIQKNQJOEDZ-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C19H18N2O3
Exact Mass 322.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXO5emM3Cqq
Name Dihydroalangimarine
Alternate Name(s) 12-ethyl-2-hydroxy-3-methoxy-5,6-dihydro-8H-isoquino[2,1-b][2,7]naphthyridin-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2O3
InChI InChI=1S/C19H18N2O3/c1-3-11-9-20-10-15-13(11)7-16-14-8-17(22)18(24-2)6-12(14)4-5-21(16)19(15)23/h6-10,22H,3-5H2,1-2H3
InChIKey NKRQIQKNQJOEDZ-UHFFFAOYSA-N
Molecular Weight 322.364 g/mol
SMILES Oc1cc2C=3N(C(=O)c4c(C3)c(cnc4)CC)CCc2cc1OC
SPLASH splash10-0ab9-0009000000-77aef1dc849abdf3d5e0
Source of Spectrum SB-136-208-24
Wiley ID 1612168