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1-Mesityl-3a-methyl-5-phenyl-3,3a,4,11-tetrahydro-[1,2,4]-oxadiazolo[4,5-a]-(1,5)-benzodiazepine
SpectraBase Compound ID ASaMKDKVScc
InChI InChI=1S/C26H25N3O/c1-17-14-18(2)24(19(3)15-17)25-28-30-26(4)16-22(20-10-6-5-7-11-20)27-21-12-8-9-13-23(21)29(25)26/h5-15H,16H2,1-4H3
InChIKey AUAGYKQVLPBRIX-UHFFFAOYSA-N
Mol Weight 395.51 g/mol
Molecular Formula C26H25N3O
Exact Mass 395.199762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qlSFdBdnP7
Name 1-Mesityl-3a-methyl-5-phenyl-3,3a,4,11-tetrahydro-[1,2,4]-oxadiazolo[4,5-a]-(1,5)-benzodiazepine
Comments Less than 3 mono-isotopic peaks
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Formula C26H25N3O
InChI InChI=1S/C26H25N3O/c1-17-14-18(2)24(19(3)15-17)25-28-30-26(4)16-22(20-10-6-5-7-11-20)27-21-12-8-9-13-23(21)29(25)26/h5-15H,16H2,1-4H3
InChIKey AUAGYKQVLPBRIX-UHFFFAOYSA-N
Molecular Weight 395.506 g/mol
SMILES C=1(N2C(ON1)(CC(c1ccccc1)=Nc1c2cccc1)C)c1c(cc(cc1C)C)C
SPLASH splash10-0a4j-9006000000-c25f42abc8eccac5e73f
Source of Spectrum AN-105-343-4
Synonyms 1-mesityl-3a-methyl-5-phenyl-3a,4-dihydro[1,2,4]oxadiazolo[4,5-a][1,5]benzodiazepine
Wiley ID 747521