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(E)-3-AMINO-1-(PARA-CHLOROPHENYL)-6-(N,N-DIMETHYLIMMONIO)-ETHYLIDENE-4-OXIDOPYRAZOLO-[3,4-D]-[3,1]-OXAZINE
SpectraBase Compound ID 9KIxhesqi1x
InChI InChI=1S/C15H13ClN5O2/c1-20(2)8-7-11-18-14-12(15(22)23-11)13(17)19-21(14)10-5-3-9(16)4-6-10/h3-8H,1-2H3,(H-,17,19)/q-1/p+1
InChIKey MJGWGCWNQVAQKC-UHFFFAOYSA-O
Mol Weight 331.76 g/mol
Molecular Formula C15H14ClN5O2
Exact Mass 331.083602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk2d42A0pkz
Name (E)-3-Amino-1-(p-chlorophenyl)-6-(N.N-dimethylimmonio)ethylidene-4-oxidopyrazolo[3,4-d][3,1]-oxazine
Alternate Name(s) (6E)-3-amino-1-(4-chlorophenyl)-6-[2-(dimethyliminio)ethylidene]-1,6-dihydropyrazolo[3,4-d][1,3]oxazin-4-olate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14ClN5O2
InChI InChI=1S/C15H13ClN5O2/c1-20(2)8-7-11-18-14-12(15(22)23-11)13(17)19-21(14)10-5-3-9(16)4-6-10/h3-8H,1-2H3,(H-,17,19)/q-1/p+1
InChIKey MJGWGCWNQVAQKC-UHFFFAOYSA-O
Molecular Weight 331.763 g/mol
SMILES NC=1C=2C(N(N1)c1ccc(cc1)Cl)=N\C(OC2[O-])=C/C=[N+](C)C
SPLASH splash10-001a-9074000000-6177da4269bd835ca786
Source of Spectrum H1-51-2903-9
Wiley ID 817452