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1(S/R)-(Methoxycarbonyl)-12(R/S)-hydroxy-5-oxo-4-azatricyclo[7.6.4.3.0.0]dodeca-6(11),7,9-triene
SpectraBase Compound ID 1MYLw05spTW
InChI InChI=1S/C13H13NO4/c1-18-12(16)10-6-7-14-11(15)8-4-2-3-5-9(8)13(10,14)17/h2-5,10,17H,6-7H2,1H3/t10-,13-/m0/s1
InChIKey NKQLQMPVKUHRTQ-GWCFXTLKSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aN1r2rU2fg
Name 1(S/R)-(Methoxycarbonyl)-12(R/S)-hydroxy-5-oxo-4-azatricyclo[7.6.4.3.0.0]dodeca-6(11),7,9-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-18-12(16)10-6-7-14-11(15)8-4-2-3-5-9(8)13(10,14)17/h2-5,10,17H,6-7H2,1H3/t10-,13-/m0/s1
InChIKey NKQLQMPVKUHRTQ-GWCFXTLKSA-N
Molecular Weight 247.250 g/mol
SMILES O[C@]12N(C(=O)c3c2cccc3)CC[C@]1(C(=O)OC)[H]
SPLASH splash10-03dr-0920000000-d48e4cfd0c5ac2192448
Source of Spectrum C-117-2708-38
Wiley ID 1697584