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(Z)-2,3-Dihydro-3-(4H-1,2,4-triazol-4-yl)-4H-1-benzopyran-4-one O-(phenylmethyl)oxime nitrate
SpectraBase Compound ID 1MQbTILqoi2
InChI InChI=1S/C18H16N4O2.HNO3/c1-2-6-14(7-3-1)10-24-21-18-15-8-4-5-9-17(15)23-11-16(18)22-12-19-20-13-22;2-1(3)4/h1-9,12-13,16H,10-11H2;(H,2,3,4)/b21-18-;
InChIKey LNLMLRZXSSHDQJ-WIPIHYDQSA-N
Mol Weight 383.36 g/mol
Molecular Formula C18H17N5O5
Exact Mass 383.122969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKW3Clbpun7
Name (Z)-2,3-Dihydro-3-(4H-1,2,4-triazol-4-yl)-4H-1-benzopyran-4-one O-(phenylmethyl)oxime nitrate
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Formula C18H17N5O5
InChI InChI=1S/C18H16N4O2.HNO3/c1-2-6-14(7-3-1)10-24-21-18-15-8-4-5-9-17(15)23-11-16(18)22-12-19-20-13-22;2-1(3)4/h1-9,12-13,16H,10-11H2;(H,2,3,4)/b21-18-;
InChIKey LNLMLRZXSSHDQJ-WIPIHYDQSA-N
Molecular Weight 383.364 g/mol
SMILES ON(=O)=O.C1C(\C(c2c(O1)cccc2)=N/OCc1ccccc1)[n]1cnnc1
SPLASH splash10-03kc-7906000000-3c5d2d37975d2b8bf4a2
Source of Spectrum H1-55-2071-17
Synonyms Nitric acid compound with (4Z)-3-(4H-1,2,4-triazol-4-yl)-2,3-dihydro-4H-chromen-4-one O-benzyloxime (1:1)
Wiley ID 1564718