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5-Amino-6-dimethylimino-2-(3-chlorophenyl)-4-oxo-2,4-dihydropyrazolo[3,4-d][1,3]oxazine

View entire compound with spectra: 1 MS (GC)

5-Amino-6-dimethylimino-2-(3-chlorophenyl)-4-oxo-2,4-dihydropyrazolo[3,4-d][1,3]oxazine
SpectraBase Compound ID J0kB5aN2Jse
InChI InChI=1S/C13H12ClN5O2/c1-18(2)13-16-11-9(12(20)21-13)10(15)19(17-11)8-5-3-4-7(14)6-8/h3-6H,15H2,1-2H3
InChIKey QGULJHGXQKIIJS-UHFFFAOYSA-N
Mol Weight 305.72 g/mol
Molecular Formula C13H12ClN5O2
Exact Mass 305.067952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JeoSr2rGXu
Name 5-Amino-6-dimethylimino-2-(3-chlorophenyl)-4-oxo-2,4-dihydropyrazolo[3,4-d][1,3]oxazine
Alternate Name(s) 3-amino-2-(3-chlorophenyl)-6-(dimethylamino)-4-pyrazolo[3,4-d][1,3]oxazinone 3-azanyl-2-(3-chlorophenyl)-6-(dimethylamino)pyrazolo[3,4-d][1,3]oxazin-4-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClN5O2
InChI InChI=1S/C13H12ClN5O2/c1-18(2)13-16-11-9(12(20)21-13)10(15)19(17-11)8-5-3-4-7(14)6-8/h3-6H,15H2,1-2H3
InChIKey QGULJHGXQKIIJS-UHFFFAOYSA-N
Molecular Weight 305.725 g/mol
SMILES Nc1c2c(N=C(OC2=O)N(C)C)n[n]1-c1cc(Cl)ccc1
SPLASH splash10-0bt9-0069000000-0831ae2d475711572537
Source of Spectrum SO-0-659-5
Wiley ID 1542352