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1-Bromo-3,6-diazahomoadamantan-9-one
SpectraBase Compound ID KUT3mOfrBLk
InChI InChI=1S/C9H13BrN2O/c10-9-5-11-1-2-12(6-9)4-7(3-11)8(9)13/h7H,1-6H2/t7-,9-
InChIKey LXLPDBWEWSOCSI-XWEPSHTISA-N
Mol Weight 245.12 g/mol
Molecular Formula C9H13BrN2O
Exact Mass 244.021126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYOxC9bD046
Name 1-Bromo-3,6-diazahomoadamantan-9-one
CAS Registry Number 175232-19-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13BrN2O
InChI InChI=1S/C9H13BrN2O/c10-9-5-11-1-2-12(6-9)4-7(3-11)8(9)13/h7H,1-6H2/t7-,9-
InChIKey LXLPDBWEWSOCSI-XWEPSHTISA-N
Molecular Weight 245.120 g/mol
SMILES [C@]12(C([C@@]3(CN(C2)CCN(C1)C3)[H])=O)Br
SPLASH splash10-052f-9350000000-4164635411c8bef02e45
Source of Spectrum O1-31-875-12
Wiley ID 818783