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3-((1H-BENZO-[D]-IMIDAZOL-2-YL)-CARBAMOYL)-7-OXABICYCLO-[2.2.1]-HEPTANE-2-CARBOXYLIC-ACID
SpectraBase Compound ID AdHluHs11sh
InChI InChI=1S/C15H15N3O4/c19-13(11-9-5-6-10(22-9)12(11)14(20)21)18-15-16-7-3-1-2-4-8(7)17-15/h1-4,9-12H,5-6H2,(H,20,21)(H2,16,17,18,19)/t9-,10+,11-,12+/m1/s1
InChIKey XKHWUOILSLVKQY-KXNHARMFSA-N
Mol Weight 301.3 g/mol
Molecular Formula C15H15N3O4
Exact Mass 301.106256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9wTMi7T3oS0
Name 3-((1H-BENZO-[D]-IMIDAZOL-2-YL)-CARBAMOYL)-7-OXABICYCLO-[2.2.1]-HEPTANE-2-CARBOXYLIC-ACID
Compound Number II-36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H15N3O4
InChI InChI=1S/C15H15N3O4/c19-13(11-9-5-6-10(22-9)12(11)14(20)21)18-15-16-7-3-1-2-4-8(7)17-15/h1-4,9-12H,5-6H2,(H,20,21)(H2,16,17,18,19)/t9-,10+,11-,12+/m1/s1
InChIKey XKHWUOILSLVKQY-KXNHARMFSA-N
Literature Reference Author Y.WANG,W.SUN,S.ZHA,H.WANG,Y.ZHANG
Literature Reference Citation MOLECULES,20,21464(2015)
Literature Reference DOI 10.3390/molecules201219782
Molecular Weight 301.302 g/mol
Solvent DMSO-D6
Source File Reference UWPA7064