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PERFRANGILIN-B
SpectraBase Compound ID U7CeexIjfF
InChI InChI=1S/C12H11NO3S2/c1-13-5-7-6(4-8(13)14)9(15)11(17-2)12(18-3)10(7)16/h4-5H,1-3H3
InChIKey YCRBNFTXGDZHPI-UHFFFAOYSA-N
Mol Weight 281.34 g/mol
Molecular Formula C12H11NO3S2
Exact Mass 281.018036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hh9hrmtm8Ki
Name 2-METHYL-6,7-DI-(METHYLTHIO)-ISOQUINOLINE-3,5,8-(2H)-TRIONE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11NO3S2
InChI InChI=1S/C12H11NO3S2/c1-13-5-7-6(4-8(13)14)9(15)11(17-2)12(18-3)10(7)16/h4-5H,1-3H3
InChIKey YCRBNFTXGDZHPI-UHFFFAOYSA-N
Literature Reference Author A.J.BLACKMAN,C.E.RALPH,B.W.SKELTON,A.H.WHITE
Literature Reference Citation AUSTR.J.CHEM.,46,213(1993)
Literature Reference DOI 10.1071/ch9930213
Molecular Weight 281.344 g/mol
Solvent CDCl3
Source File Reference UWPR1525