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2-PHENYL-4'-METHYLBENZO-[D]-BENZO-[H]-6-AZA-1,3-DIOXA-2-BORACYCLONON-6-ENE
SpectraBase Compound ID 7lsqmRQS0jG
InChI InChI=1S/C20H16BNO2/c1-15-11-12-20-18(13-15)22-14-16-7-5-6-10-19(16)23-21(22,24-20)17-8-3-2-4-9-17/h2-14H,1H3
InChIKey SEMAJCIKGJJITL-UHFFFAOYSA-N
Mol Weight 313.2 g/mol
Molecular Formula C20H16BNO2
Exact Mass 313.127409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dy2NQGzeDJn
Name (1S)-13-methyl-1-phenyl-2,17-dioxa-10.lambda.4-aza- 1.lambda.4- boratetracyclo[8.7.0.0(3,8).0(11,16)]heptadeca-3(8),4,6,9,11(16),12,14-heptaene
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Formula C20H16BNO2
InChI InChI=1S/C20H16BNO2/c1-15-11-12-20-18(13-15)22-14-16-7-5-6-10-19(16)23-21(22,24-20)17-8-3-2-4-9-17/h2-14H,1H3
InChIKey SEMAJCIKGJJITL-UHFFFAOYSA-N
Molecular Weight 313.163 g/mol
SMILES c12[N]=3[B](Oc1ccc(c2)C)(Oc1c(C3)cccc1)c1ccccc1
SPLASH splash10-03di-0419000000-9c7a997e67254d44274e
Source of Spectrum I-79-1235-2
Synonyms (1S)-13-methyl-1-phenyl-2,17-dioxa-10-aza-1-boratetracyclo[8.7.0.0(3,8).0(11,16)]heptadeca-3(8),4,6,9,11(16),12,14-heptaene 2-Phenyl-3'-methylbenzo[d]benzo[h]-6-aza-1,3-dioxa-2-boracyclononan-6-ene
Wiley ID 842302