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7-(diethylamino)-3-phenethylchromeno[3,4-d][1,2,3]triazol-4(3H)-one
SpectraBase Compound ID J5ntt5GOvAq
InChI InChI=1S/C21H22N4O2/c1-3-24(4-2)16-10-11-17-18(14-16)27-21(26)20-19(17)22-23-25(20)13-12-15-8-6-5-7-9-15/h5-11,14H,3-4,12-13H2,1-2H3
InChIKey OXPJCRBJGUMHPZ-UHFFFAOYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C21H22N4O2
Exact Mass 362.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IeDSPb8BNRs
Name 7-(diethylamino)-3-phenethylchromeno[3,4-d][1,2,3]triazol-4(3H)-one
Appearance White crystals
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Exact Mass 362.174275962 u
Formula C21H22N4O2
InChI InChI=1S/C21H22N4O2/c1-3-24(4-2)16-10-11-17-18(14-16)27-21(26)20-19(17)22-23-25(20)13-12-15-8-6-5-7-9-15/h5-11,14H,3-4,12-13H2,1-2H3
InChIKey OXPJCRBJGUMHPZ-UHFFFAOYSA-N
Instrument Name JEOL JMS-700MS
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202300013
Molecular Weight 362.433 g/mol
Quality 193
Reported Formula C21H22N4O2
SMILES C(C)N(CC)C=1C=CC2=C(C1)OC(C=1N(N=NC21)CCC1=CC=CC=C1)=O
SPLASH splash10-03di-0209000000-10d7afc64184f94f5c0b
Source of Spectrum AJO-12-9-syn-13 (DOI: 10.1002/ajoc.202300013)
Wiley ID 1909736