Debug Info

object
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_id
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8t5NNrIpYuR
spectrumID
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8t5NNrIpYuR
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Mass Spectrum (GC)
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3-Amino-6-(4-bromophenyl)-2-(4-chlorophenyl)-4-oxo-4H-pyrano[4,3-c]pyrazole
SpectraBase Compound ID ASMXITp8pt6
InChI InChI=1S/C18H11BrClN3O2/c19-11-3-1-10(2-4-11)15-9-14-16(18(24)25-15)17(21)23(22-14)13-7-5-12(20)6-8-13/h1-9H,21H2
InChIKey UYQVWXKAGCCPCD-UHFFFAOYSA-N
Mol Weight 416.66 g/mol
Molecular Formula C18H11BrClN3O2
Exact Mass 414.972317 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8t5NNrIpYuR
Name 3-Amino-6-(4-bromophenyl)-2-(4-chlorophenyl)-4-oxo-4H-pyrano[4,3-c]pyrazole
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11BrClN3O2
InChI InChI=1S/C18H11BrClN3O2/c19-11-3-1-10(2-4-11)15-9-14-16(18(24)25-15)17(21)23(22-14)13-7-5-12(20)6-8-13/h1-9H,21H2
InChIKey UYQVWXKAGCCPCD-UHFFFAOYSA-N
Molecular Weight 416.662 g/mol
SMILES Nc1[n](nc2c1C(OC(=C2)c1ccc(cc1)Br)=O)-c1ccc(cc1)Cl
SPLASH splash10-014i-0001900000-f505d358f9a3b25bfd43
Source of Spectrum Y1-41-365-21
Synonyms 3-Amino-6-(4-bromophenyl)-2-(4-chlorophenyl)pyrano[4,3-c]pyrazol-4(2H)-one
Wiley ID 1564931
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