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1,2,3,4,6,10,11,11A-OCTAHYDROPYRIDO-[1,2-A]-THIENO-[3,2-E]-AZEPIN-10-OL
SpectraBase Compound ID 7QHxNZsHihW
InChI InChI=1S/C12H17NOS/c14-11-7-9-3-1-2-5-13(9)8-12-10(11)4-6-15-12/h4,6,9,11,14H,1-3,5,7-8H2/t9-,11+/m1/s1
InChIKey CCGFVAWPRRWGQD-KOLCDFICSA-N
Mol Weight 223.33 g/mol
Molecular Formula C12H17NOS
Exact Mass 223.103085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3APN20eOtC
Name 1,2,3,4,6,10,11,11A-OCTAHYDROPYRIDO-[1,2-A]-THIENO-[3,2-E]-AZEPIN-10-OL
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17NOS
InChI InChI=1S/C12H17NOS/c14-11-7-9-3-1-2-5-13(9)8-12-10(11)4-6-15-12/h4,6,9,11,14H,1-3,5,7-8H2/t9-,11+/m1/s1
InChIKey CCGFVAWPRRWGQD-KOLCDFICSA-N
Literature Reference Author D.BERKES,B.DECROIX
Literature Reference Citation BULL.SOC.CHIM.FR.,131,986(1994)
Molecular Weight 223.333 g/mol
Solvent CDCl3
Source File Reference UWSK2865