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N-((3s,5s,7s)-Adamantan-1-yl)-4-bromobenzamide
SpectraBase Compound ID 8XAqMkmAPwO
InChI InChI=1S/C17H20BrNO/c18-15-3-1-14(2-4-15)16(20)19-17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2,(H,19,20)/t11-,12+,13-,17-
InChIKey BPODQLGKAZLQDT-FBBPANFNSA-N
Mol Weight 334.26 g/mol
Molecular Formula C17H20BrNO
Exact Mass 333.072827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dCJxogh99i
Name N-((3s,5s,7s)-Adamantan-1-yl)-4-bromobenzamide
Appearance White solid
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Formula C17H20BrNO
InChI InChI=1S/C17H20BrNO/c18-15-3-1-14(2-4-15)16(20)19-17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2,(H,19,20)/t11-,12+,13-,17-
InChIKey BPODQLGKAZLQDT-FBBPANFNSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702015
Molecular Weight 334.257 g/mol
Quality 287
SMILES N(C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])C(C1=CC=C(C=C1)Br)=O
SPLASH splash10-057r-2944000000-2aa301082d846896ac2e
Source of Spectrum QE-23-13377-9b (DOI: 10.1002/chem.201702015)
Wiley ID 1905862