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3-(2'-NITRO-4',5'-METHYLENEDIOXY)-PHENYL-PROPANOL
SpectraBase Compound ID TcCiN9gzvw
InChI InChI=1S/C10H11NO5/c12-3-1-2-7-4-9-10(16-6-15-9)5-8(7)11(13)14/h4-5,12H,1-3,6H2
InChIKey ZPORPASSBNRQGW-UHFFFAOYSA-N
Mol Weight 225.2 g/mol
Molecular Formula C10H11NO5
Exact Mass 225.063722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9SvyYCr0GnG
Name 3-(2'-NITRO-4',5'-METHYLENEDIOXY)-PHENYL-PROPANOL
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H11NO5
InChI InChI=1S/C10H11NO5/c12-3-1-2-7-4-9-10(16-6-15-9)5-8(7)11(13)14/h4-5,12H,1-3,6H2
InChIKey ZPORPASSBNRQGW-UHFFFAOYSA-N
Literature Reference Author H.CARRASCO,M.RAIMONDI,L.SVETAZ,M.DILIBERTO,M.V.RODRIGUEZ,L.E SPINOZA,A.MADRID,S.Z
Literature Reference Citation MOLECULES,17,1002(2012)
Literature Reference DOI 10.3390/molecules17011002
Molecular Weight 225.201 g/mol
Sample ID 73078
Solvent CDCl3