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4-BENZYL-9B-METHOXY-6A-METHYL-2,3,9A,9B-TETRAHYDRO-9H-PYRAZOLO-[3,4-H]-1,4-BENZOXAZIN-6(6AH)-ONE
SpectraBase Compound ID 1rjmWPrJCmv
InChI InChI=1S/C18H21N3O3/c1-17-14(11-19-20-17)18(23-2)15(10-16(17)22)21(8-9-24-18)12-13-6-4-3-5-7-13/h3-7,10,14H,8-9,11-12H2,1-2H3/t14-,17+,18-/m0/s1
InChIKey CMLGWEILYWRBDW-QGTPRVQTSA-N
Mol Weight 327.38 g/mol
Molecular Formula C18H21N3O3
Exact Mass 327.158292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HmEWRIAWdcz
Name 4-BENZYL-9B-METHOXY-6A-METHYL-2,3,9A,9B-TETRAHYDRO-9H-PYRAZOLO-[3,4-H]-1,4-BENZOXAZIN-6(6AH)-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21N3O3
InChI InChI=1S/C18H21N3O3/c1-17-14(11-19-20-17)18(23-2)15(10-16(17)22)21(8-9-24-18)12-13-6-4-3-5-7-13/h3-7,10,14H,8-9,11-12H2,1-2H3/t14-,17+,18-/m0/s1
InChIKey CMLGWEILYWRBDW-QGTPRVQTSA-N
Literature Reference Author M.SCHUBERT-ZSILAVECZ
Literature Reference Citation MH.CHEM.,122,51(1991)
Literature Reference DOI 10.1007/BF00815165
Molecular Weight 327.383 g/mol
Solvent DMSO
Source File Reference UWFP47