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3,11-Diazatricyclo[7.3.1.0(3,8)]trideca-5,7-dien-4-one, 11-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]-
SpectraBase Compound ID CguhKIvZU7P
InChI InChI=1S/C19H21BrN2O3/c1-25-17-7-12(6-15(20)19(17)24)8-21-9-13-5-14(11-21)16-3-2-4-18(23)22(16)10-13/h2-4,6-7,13-14,24H,5,8-11H2,1H3
InChIKey CFDBOLQTHZTVLZ-UHFFFAOYSA-N
Mol Weight 405.29 g/mol
Molecular Formula C19H21BrN2O3
Exact Mass 404.073556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tqxUOLKAdw
Name 3,11-Diazatricyclo[7.3.1.0(3,8)]trideca-5,7-dien-4-one, 11-[(3-bromo-4-hydroxy-5-methoxyphenyl)methyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21BrN2O3
InChI InChI=1S/C19H21BrN2O3/c1-25-17-7-12(6-15(20)19(17)24)8-21-9-13-5-14(11-21)16-3-2-4-18(23)22(16)10-13/h2-4,6-7,13-14,24H,5,8-11H2,1H3
InChIKey CFDBOLQTHZTVLZ-UHFFFAOYSA-N
Molecular Weight 405.292 g/mol
SMILES Oc1c(cc(CN2CC3CN4C(C(C2)C3)=CC=CC4=O)cc1Br)OC
SPLASH splash10-000e-9710100000-f6ecf3af2d903079ccdd
Source of Spectrum IY-1-4609-0
Wiley ID 1654073