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ISOARNOTTIANAMIDE
SpectraBase Compound ID H1BQLwn7C7r
InChI InChI=1S/C21H19NO6/c1-22(10-23)21-13(15-8-17(25-2)18(26-3)9-16(15)24)5-4-12-6-19-20(7-14(12)21)28-11-27-19/h4-10,24H,11H2,1-3H3
InChIKey VAAALYZSWYRNHB-UHFFFAOYSA-N
Mol Weight 381.38 g/mol
Molecular Formula C21H19NO6
Exact Mass 381.121237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HGSzmG15kIs
Name ISOARNOTTIANAMIDE
CAS Registry Number 60394-91-4
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19NO6
InChI InChI=1S/C21H19NO6/c1-22(10-23)21-13(15-8-17(25-2)18(26-3)9-16(15)24)5-4-12-6-19-20(7-14(12)21)28-11-27-19/h4-10,24H,11H2,1-3H3
InChIKey VAAALYZSWYRNHB-UHFFFAOYSA-N
Literature Reference Author J.J.HSIAO,H.C.CHIANG
Literature Reference Citation PHYTOCHEM.,39,899(1995)
Literature Reference DOI 10.1016/0031-9422(95)00072-F
Molecular Weight 381.385 g/mol
Solvent DMSO-D6
Source File Reference UWMZ8899