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(+-)-[6aS*-(6.alpha.,6a.beta.,10a.beta.,11.alpha.)]-5,6a,7,8,10a,11-hexhydro-6,11-methano-6H-1,3-benzodioxolo[5,6-c][1]benzazaepine
SpectraBase Compound ID Eo3VUbithNi
InChI InChI=1S/C16H17NO2/c1-2-4-14-11(3-1)13-8-17(14)7-10-5-15-16(6-12(10)13)19-9-18-15/h1,3,5-6,11,13-14H,2,4,7-9H2/t11-,13+,14-/m1/s1
InChIKey SROKDQMOZCEOJH-KWCYVHTRSA-N
Mol Weight 255.32 g/mol
Molecular Formula C16H17NO2
Exact Mass 255.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WKkYq3yXgT
Name (+-)-[6aS*-(6.alpha.,6a.beta.,10a.beta.,11.alpha.)]-5,6a,7,8,10a,11-hexhydro-6,11-methano-6H-1,3-benzodioxolo[5,6-c][1]benzazaepine
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Formula C16H17NO2
InChI InChI=1S/C16H17NO2/c1-2-4-14-11(3-1)13-8-17(14)7-10-5-15-16(6-12(10)13)19-9-18-15/h1,3,5-6,11,13-14H,2,4,7-9H2/t11-,13+,14-/m1/s1
InChIKey SROKDQMOZCEOJH-KWCYVHTRSA-N
Molecular Weight 255.317 g/mol
SMILES C1N2[C@]3([C@@]([C@]1(c1c(C2)cc2c(OCO2)c1)[H])(C=CCC3)[H])[H]
SPLASH splash10-0550-0590000000-07235ddced7744e03820
Source of Spectrum J-58-4669-28
Synonyms (1S,13R,18R)-5,7-dioxa-12-azapentacyclo[10.6.1.0(2,10).0(4,8).0(13,18)]nonadeca-2(10),3,8,16-tetraene
Wiley ID 1258963