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5-Amino-1-methyl-3-phenyl-1H-pyrazole-4-carbothialdehyde

View entire compound with spectra: 1 MS (GC)

5-Amino-1-methyl-3-phenyl-1H-pyrazole-4-carbothialdehyde
SpectraBase Compound ID Gk4bQouML0c
InChI InChI=1S/C11H11N3S/c1-14-11(12)9(7-15)10(13-14)8-5-3-2-4-6-8/h2-7H,12H2,1H3
InChIKey CNQRFADXYMCTRN-UHFFFAOYSA-N
Mol Weight 217.29 g/mol
Molecular Formula C11H11N3S
Exact Mass 217.067369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1jaCIbi9pv
Name 5-Amino-1-methyl-3-phenyl-1H-pyrazole-4-carbothialdehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3S
InChI InChI=1S/C11H11N3S/c1-14-11(12)9(7-15)10(13-14)8-5-3-2-4-6-8/h2-7H,12H2,1H3
InChIKey CNQRFADXYMCTRN-UHFFFAOYSA-N
Molecular Weight 217.290 g/mol
SMILES Nc1[n](nc(c1C=S)-c1ccccc1)C
SPLASH splash10-014i-1090000000-a8a421da97e9b3c8c2a4
Source of Spectrum SO-0-610-3
Synonyms 5-Amino-1-methyl-3-phenyl-4-pyrazolecarbothioaldehyde 5-Amino-1-methyl-3-phenyl-pyrazole-4-carbothialdehyde 5-Azanyl-1-methyl-3-phenyl-pyrazole-4-carbothialdehyde
Wiley ID 1542276