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5-Amino-3-tert-butyl-1-phenyl-1H-pyrazole-4-carbothialdehyde
SpectraBase Compound ID cHyYoWXq9N
InChI InChI=1S/C14H17N3S/c1-14(2,3)12-11(9-18)13(15)17(16-12)10-7-5-4-6-8-10/h4-9H,15H2,1-3H3
InChIKey UZBDPBAACHUONY-UHFFFAOYSA-N
Mol Weight 259.37 g/mol
Molecular Formula C14H17N3S
Exact Mass 259.114319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FufWxVKkCry
Name 5-Amino-3-tert-butyl-1-phenyl-1H-pyrazole-4-carbothialdehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3S
InChI InChI=1S/C14H17N3S/c1-14(2,3)12-11(9-18)13(15)17(16-12)10-7-5-4-6-8-10/h4-9H,15H2,1-3H3
InChIKey UZBDPBAACHUONY-UHFFFAOYSA-N
Molecular Weight 259.371 g/mol
SMILES Nc1[n](nc(c1C=S)C(C)(C)C)-c1ccccc1
SPLASH splash10-056r-3090000000-b3756e8240b6292ceec7
Source of Spectrum SO-0-610-3
Synonyms 5-Amino-3-tert-butyl-1-phenyl-4-pyrazolecarbothioaldehyde 5-Amino-3-tert-butyl-1-phenyl-pyrazole-4-carbothialdehyde 5-Azanyl-3-tert-butyl-1-phenyl-pyrazole-4-carbothialdehyde
Wiley ID 1542274