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(4S)-[(3AS,6AR)-HEPT-6-YNYL]-TETRAHYDRO-1H-THIENO-[3,4-D]-IMIDAZOL-2(3H)-ONE
SpectraBase Compound ID 785GeT9gdbw
InChI InChI=1S/C12H18N2OS/c1-2-3-4-5-6-7-10-11-9(8-16-10)13-12(15)14-11/h1,9-11H,3-8H2,(H2,13,14,15)/t9-,10-,11-/m0/s1
InChIKey HWFZBYFQQMRYQB-DCAQKATOSA-N
Mol Weight 238.35 g/mol
Molecular Formula C12H18N2OS
Exact Mass 238.113984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ErwN3i9Zxyx
Name (4S)-[(3AS,6AR)-HEPT-6-YNYL]-TETRAHYDRO-1H-THIENO-[3,4-D]-IMIDAZOL-2(3H)-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18N2OS
InChI InChI=1S/C12H18N2OS/c1-2-3-4-5-6-7-10-11-9(8-16-10)13-12(15)14-11/h1,9-11H,3-8H2,(H2,13,14,15)/t9-,10-,11-/m0/s1
InChIKey HWFZBYFQQMRYQB-DCAQKATOSA-N
Literature Reference Author J.C.IGLESIAS-SANCHEZ,D.S.MARIA,R.M.CLARAMUNT,J.ELGUERO
Literature Reference Citation MOLECULES,15,1213(2010)
Literature Reference DOI 10.3390/molecules15031213
Molecular Weight 238.348 g/mol
Sample ID 70152
Solvent CDCl3