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(Z)-2,3-Dihydro-3-(1H-1,2,4-triazol-1-yl)-4H-1-benzopyran-4-one O-(phenylmethyl)oxime nitrate
SpectraBase Compound ID 6L8HwnNZU4O
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)22-13-19-12-20-22;2-1(3)4/h1-9,12-13,16H,10-11H2;(H,2,3,4)/b21-18-;
InChIKey XOUJGLFUFORQNO-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 8qQzgRD8vzK
Name (Z)-2,3-Dihydro-3-(1H-1,2,4-triazol-1-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)22-13-19-12-20-22;2-1(3)4/h1-9,12-13,16H,10-11H2;(H,2,3,4)/b21-18-;
InChIKey XOUJGLFUFORQNO-WIPIHYDQSA-N
Molecular Weight 383.364 g/mol
SMILES ON(=O)=O.C1C(\C(c2c(O1)cccc2)=N/OCc1ccccc1)[n]1ncnc1
SPLASH splash10-0006-9202000000-e69e3c89d5b186995157
Source of Spectrum H1-55-2070-13
Synonyms Nitric acid compound with (4Z)-3-(1H-1,2,4-triazol-1-yl)-2,3-dihydro-4H-chromen-4-one O-benzyloxime (1:1)
Wiley ID 1564723