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1H-Pyrazole-3-carboxamide, 4-iodo-N-[4-(5-isoxazolyl)phenyl]-1-methyl-
SpectraBase Compound ID HulC2NI2PEy
InChI InChI=1S/C14H11IN4O2/c1-19-8-11(15)13(18-19)14(20)17-10-4-2-9(3-5-10)12-6-7-16-21-12/h2-8H,1H3,(H,17,20)
InChIKey QPQDDTRXJNYTJZ-UHFFFAOYSA-N
Mol Weight 394.17 g/mol
Molecular Formula C14H11IN4O2
Exact Mass 393.992671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxJNkzm8pbN
Name 1H-Pyrazole-3-carboxamide, 4-iodo-N-[4-(5-isoxazolyl)phenyl]-1-methyl-
Alternate Name(s) 4-iodo-N-[4-(5-isoxazolyl)phenyl]-1-methyl-3-pyrazolecarboxamide 4-iodo-1-methyl-N-[4-(1,2-oxazol-5-yl)phenyl]pyrazole-3-carboxamide 4-iodanyl-1-methyl-N-[4-(1,2-oxazol-5-yl)phenyl]pyrazole-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11IN4O2
InChI InChI=1S/C14H11IN4O2/c1-19-8-11(15)13(18-19)14(20)17-10-4-2-9(3-5-10)12-6-7-16-21-12/h2-8H,1H3,(H,17,20)
InChIKey QPQDDTRXJNYTJZ-UHFFFAOYSA-N
Molecular Weight 394.172 g/mol
SMILES N(C(=O)c1n[n](cc1I)C)c1ccc(cc1)-c1ccno1
SPLASH splash10-000i-9372000000-98e826b9ca0506ec46c2
Source of Spectrum IY-1-4642-3
Wiley ID 1654406