SpectraBase Compound ID | 2AKGp3T1b9V |
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InChI | InChI=1S/2C14H9ClN4O.H2O/c2*15-11-3-1-9(2-4-11)12(20)14-17-13(18-19-14)10-5-7-16-8-6-10;/h2*1-8H,(H,17,18,19);1H2 |
InChIKey | CUJKORRSMSHBTI-UHFFFAOYSA-N |
Mol Weight | 293.713 g/mol |
Molecular Formula | C14H9ClN4O·½H2O |
Exact Mass | 293.051771 g/mol |
SpectraBase Spectrum ID | FjLkPNs6oHF |
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Name | p-chlorophenyl 3-(4-pyridyl)-s-triazol-5-yl ketone, hemihydrate |
Conditions | Acidic |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C14H11ClN4O2 |
InChI | InChI=1S/2C14H9ClN4O.H2O/c2*15-11-3-1-9(2-4-11)12(20)14-17-13(18-19-14)10-5-7-16-8-6-10;/h2*1-8H,(H,17,18,19);1H2 |
InChIKey | CUJKORRSMSHBTI-UHFFFAOYSA-N |
Sadtler IR Number | 38992 |
Sadtler UV Number | 37429A |
Solvent | Methanol |