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SYN-3-CARBOMETHOXY-3-(1'-ACETOXYBUTYL)-1-PYRAZOLINE;MAJOR_STEREOMER
SpectraBase Compound ID Kt2KsNLPKgn
InChI InChI=1S/C11H18N2O4/c1-4-5-9(17-8(2)14)11(10(15)16-3)6-7-12-13-11/h9H,4-7H2,1-3H3/t9-,11-/m1/s1
InChIKey SOZFUDHRSJJZOC-MWLCHTKSSA-N
Mol Weight 242.27 g/mol
Molecular Formula C11H18N2O4
Exact Mass 242.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DfyA16cyghx
Name SYN-3-CARBOMETHOXY-3-(1'-ACETOXYBUTYL)-1-PYRAZOLINE;MAJOR_STEREOMER
Compound Number 33A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18N2O4
InChI InChI=1S/C11H18N2O4/c1-4-5-9(17-8(2)14)11(10(15)16-3)6-7-12-13-11/h9H,4-7H2,1-3H3/t9-,11-/m1/s1
InChIKey SOZFUDHRSJJZOC-MWLCHTKSSA-N
Literature Reference Author R.ANNUNZIATA,M.BENAGLIA,M.CINQUINI,F.COZZI,L.RAIMONDI
Literature Reference Citation J.ORG.CHEM.,60,4697(1995)
Literature Reference DOI 10.1021/jo00120a009
Molecular Weight 242.275 g/mol
Solvent CDCl3
Source File Reference UWMZ2180