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3A,4,9,9A-TETRAHYDRO-3.9A-DIMETHYL-4-PHENYL-ISOXAZOLO-[5,4-D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID 1aHXhM2xDvM
InChI InChI=1S/C14H15N5O/c1-9-11-12(10-6-4-3-5-7-10)19-13(15-8-16-19)17-14(11,2)20-18-9/h3-8,11-12H,1-2H3,(H,15,16,17)/t11-,12-,14-/m0/s1
InChIKey PSWUECBRCBEJAZ-OBJOEFQTSA-N
Mol Weight 269.31 g/mol
Molecular Formula C14H15N5O
Exact Mass 269.12766 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1AOYLeZBz13
Name 3A,4,9,9A-TETRAHYDRO-3.9A-DIMETHYL-4-PHENYL-ISOXAZOLO-[5,4-D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H15N5O
InChI InChI=1S/C14H15N5O/c1-9-11-12(10-6-4-3-5-7-10)19-13(15-8-16-19)17-14(11,2)20-18-9/h3-8,11-12H,1-2H3,(H,15,16,17)/t11-,12-,14-/m0/s1
InChIKey PSWUECBRCBEJAZ-OBJOEFQTSA-N
Literature Reference Author S.M.DESENKO,S.A.KOMYKHOV,V.D.ORLOV,H.MEIER
Literature Reference Citation J.HETCYCL.CHEM.,35,989(1998)
Literature Reference DOI 10.1002/jhet.5570350434
Molecular Weight 269.306 g/mol
Solvent CDCl3
Source File Reference UWCS25163