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(3SR,3ASR)-3-HYDROXY-2-(4-NITROPHENYL)-3A,4-DIHYDRO-3H-PYRAZOLO-[1,5-A]-INDOLE
SpectraBase Compound ID 66Hj53DM7iU
InChI InChI=1S/C16H13N3O3/c20-16-14-9-11-3-1-2-4-13(11)18(14)17-15(16)10-5-7-12(8-6-10)19(21)22/h1-8,14,16,20H,9H2/t14-,16-/m1/s1
InChIKey NSKTXFGBZXVIOM-GDBMZVCRSA-N
Mol Weight 295.3 g/mol
Molecular Formula C16H13N3O3
Exact Mass 295.095691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3dpFjH3gVBk
Name (3SR,3ASR)-3-HYDROXY-2-(4-NITROPHENYL)-3A,4-DIHYDRO-3H-PYRAZOLO-[1,5-A]-INDOLE
Compound Number 9F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13N3O3
InChI InChI=1S/C16H13N3O3/c20-16-14-9-11-3-1-2-4-13(11)18(14)17-15(16)10-5-7-12(8-6-10)19(21)22/h1-8,14,16,20H,9H2/t14-,16-/m1/s1
InChIKey NSKTXFGBZXVIOM-GDBMZVCRSA-N
Literature Reference Author J.K.SHEN,H.KATAYAMA,N.TAKATSU,I.SHIRO
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2087(1993)
Literature Reference DOI 10.1039/p19930002087
Molecular Weight 295.298 g/mol
Solvent CDCl3
Source File Reference UWCP1498