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(6S,7R)-7-(4-bromophenyl)-6-methyl-6-phenyl-1,4-diazabicyclo[3.2.0]hept-4-ene
SpectraBase Compound ID HXHyBloaLYp
InChI InChI=1S/C18H17BrN2/c1-18(14-5-3-2-4-6-14)16(21-12-11-20-17(18)21)13-7-9-15(19)10-8-13/h2-10,16H,11-12H2,1H3/t16-,18+/m1/s1
InChIKey FXNOGYXYUXTKNP-AEFFLSMTSA-N
Mol Weight 341.25 g/mol
Molecular Formula C18H17BrN2
Exact Mass 340.057512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5asBr0fYPe
Name (6S,7R)-7-(4-bromophenyl)-6-methyl-6-phenyl-1,4-diazabicyclo[3.2.0]hept-4-ene
Comments Less than 3 mono-isotopic peaks
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Formula C18H17BrN2
InChI InChI=1S/C18H17BrN2/c1-18(14-5-3-2-4-6-14)16(21-12-11-20-17(18)21)13-7-9-15(19)10-8-13/h2-10,16H,11-12H2,1H3/t16-,18+/m1/s1
InChIKey FXNOGYXYUXTKNP-AEFFLSMTSA-N
Molecular Weight 341.252 g/mol
SMILES C1=2[C@](c3ccccc3)(C)[C@](N1CCN2)(c1ccc(cc1)Br)[H]
SPLASH splash10-0f6x-0509000000-44a3b7b46e3bce1225e0
Source of Spectrum KC-61-1534-5
Wiley ID 1627626