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10-CHLORO-5-ETHOXYCARBONYLMETHYL-1,2,7,11B-TETRAHYDRO-1-METHOXYCARBONYLISOXAZOLO-[2,3-D]-[1,4]-BENZODIAZEPIN-6(5H)-ONE
SpectraBase Compound ID 26XjL7DR1Cu
InChI InChI=1S/C17H19ClN2O6/c1-3-25-14(21)7-13-16(22)19-12-5-4-9(18)6-10(12)15-11(17(23)24-2)8-26-20(13)15/h4-6,11,13,15H,3,7-8H2,1-2H3,(H,19,22)/t11-,13-,15-/m0/s1
InChIKey FTGRYUWMJUCUSM-WHOFXGATSA-N
Mol Weight 382.8 g/mol
Molecular Formula C17H19ClN2O6
Exact Mass 382.093164 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hqsLCkhdEx
Name 10-CHLORO-5-ETHOXYCARBONYLMETHYL-1,2,7,11B-TETRAHYDRO-1-METHOXYCARBONYLISOXAZOLO-[2,3-D]-[1,4]-BENZODIAZEPIN-6(5H)-ONE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19ClN2O6
InChI InChI=1S/C17H19ClN2O6/c1-3-25-14(21)7-13-16(22)19-12-5-4-9(18)6-10(12)15-11(17(23)24-2)8-26-20(13)15/h4-6,11,13,15H,3,7-8H2,1-2H3,(H,19,22)/t11-,13-,15-/m0/s1
InChIKey FTGRYUWMJUCUSM-WHOFXGATSA-N
Literature Reference Author F.HEANEY,S.BOURKE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,955(1998)
Literature Reference DOI 10.1039/a707078k
Molecular Weight 382.801 g/mol
Solvent CDCl3
Source File Reference UWGE2513