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5-Phenylamino-3-methyl-6-(2-phenylhydrazino)-3a,5,6,6a-tetrahydro-4H-pyrrolo[3,4-d]soxazole-4-one
SpectraBase Compound ID A5tHPAWqAww
InChI InChI=1S/C18H19N5O2/c1-12-15-16(25-22-12)17(20-19-13-8-4-2-5-9-13)23(18(15)24)21-14-10-6-3-7-11-14/h2-11,15-17,19-21H,1H3/t15-,16+,17+/m0/s1
InChIKey PDHOOQMGTSGVOV-GVDBMIGSSA-N
Mol Weight 337.38 g/mol
Molecular Formula C18H19N5O2
Exact Mass 337.153875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C61l6sXE8QS
Name 5-Phenylamino-3-methyl-6-(2-phenylhydrazino)-3a,5,6,6a-tetrahydro-4H-pyrrolo[3,4-d]soxazole-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19N5O2
InChI InChI=1S/C18H19N5O2/c1-12-15-16(25-22-12)17(20-19-13-8-4-2-5-9-13)23(18(15)24)21-14-10-6-3-7-11-14/h2-11,15-17,19-21H,1H3/t15-,16+,17+/m0/s1
InChIKey PDHOOQMGTSGVOV-GVDBMIGSSA-N
Molecular Weight 337.383 g/mol
SMILES N([C@@]1(N(C([C@]2(C(=NO[C@@]12[H])C)[H])=O)Nc1ccccc1)[H])Nc1ccccc1
SPLASH splash10-0006-9210000000-9d08ff492e76de42e69b
Source of Spectrum KC-57-4395-9
Synonyms (3aS,6R,6aR)-5-anilino-3-methyl-6-(phenylhydrazo)-6,6a-dihydro-3aH-pyrrolo[3,4-d]isoxazol-4-one (3aS,6R,6aR)-5-anilino-3-methyl-6-(2-phenylhydrazinyl)-6,6a-dihydro-3aH-pyrrolo[3,4-d][1,2]oxazol-4-one (3aS,6R,6aR)-5-anilino-3-methyl-6-(2-phenylhydrazino)-6,6a-dihydro-3aH-pyrrolo[3,4-d]isoxazol-4-one (3aS,6R,6aR)-3-methyl-5-phenylazanyl-6-(2-phenylhydrazinyl)-6,6a-dihydro-3aH-pyrrolo[3,4-d][1,2]oxazol-4-one
Wiley ID 1624200