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3,9-Epoxy-6'-methoxyruban-2-one
SpectraBase Compound ID 1kKYzURz8At
InChI InChI=1S/C18H18N2O3/c1-22-11-2-3-14-13(9-11)12(4-6-19-14)17-15-8-10-5-7-20(15)18(21)16(10)23-17/h2-4,6,9-10,15-17H,5,7-8H2,1H3/t10-,15+,16-,17+/m1/s1
InChIKey NXYUJZSMGZEYEQ-SQBBPKDDSA-N
Mol Weight 310.35 g/mol
Molecular Formula C18H18N2O3
Exact Mass 310.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AWsPCJuaTiR
Name 3,9-Epoxy-6'-methoxyruban-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O3
InChI InChI=1S/C18H18N2O3/c1-22-11-2-3-14-13(9-11)12(4-6-19-14)17-15-8-10-5-7-20(15)18(21)16(10)23-17/h2-4,6,9-10,15-17H,5,7-8H2,1H3/t10-,15+,16-,17+/m1/s1
InChIKey NXYUJZSMGZEYEQ-SQBBPKDDSA-N
Molecular Weight 310.353 g/mol
SMILES C1(N2[C@@]3([C@@](O[C@]1([H])[C@@](C3)(CC2)[H])(c1c2c(ccc(c2)OC)ncc1)[H])[H])=O
SPLASH splash10-03di-0297000000-f59332a1021a2c8f2fe6
Source of Spectrum H-81-1438-6
Synonyms (1S,5S,8R)-5-(6-Methoxy-quinolin-4-yl)-4-oxa-1-aza-tricyclo[4.4.0.0(3,8)]decan-2-one
Wiley ID 1311624