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1-ADAMANTYL-3-ETHOXYCARBONYL-1,4-DIHYDRO-1,2,4-TRIAZOLO-[5.1-C]-1,2,4-TRIAZIN-4-ONE
SpectraBase Compound ID KGh5vxnVAx1
InChI InChI=1S/C17H21N5O3/c1-2-25-15(24)13-14(23)21-16(18-9-19-21)22(20-13)17-6-10-3-11(7-17)5-12(4-10)8-17/h9-12H,2-8H2,1H3/t10-,11-,12-,17+
InChIKey HIMOCRDDVQPEDR-FRZYKALDSA-N
Mol Weight 343.39 g/mol
Molecular Formula C17H21N5O3
Exact Mass 343.16444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AM4FnWclvwY
Name 1-ADAMANTYL-3-ETHOXYCARBONYL-1,4-DIHYDRO-1,2,4-TRIAZOLO-[5.1-C]-1,2,4-TRIAZIN-4-ONE
Compound Number IIID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21N5O3
InChI InChI=1S/C17H21N5O3/c1-2-25-15(24)13-14(23)21-16(18-9-19-21)22(20-13)17-6-10-3-11(7-17)5-12(4-10)8-17/h9-12H,2-8H2,1H3/t10-,11-,12-,17+
InChIKey HIMOCRDDVQPEDR-FRZYKALDSA-N
Literature Reference Author E.N.ULOMSKII,S.L.DEEV,A.V.TKACHEV,I.K.MOISEEV,V.L.RUSINOV
Literature Reference Citation RUSS.J.ORG.CHEM.,38,272(2002)
Literature Reference DOI 10.1023/A:1015538322029
Molecular Weight 343.385 g/mol
Solvent DMSO-D6