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2-exo-chloro-4-azahomoadamantan-5-one
SpectraBase Compound ID 5fcOBynxAkh
InChI InChI=1S/C10H14ClNO/c11-9-5-12-4-6-1-7(9)3-8(2-6)10(12)13/h6-9H,1-5H2/t6-,7+,8-,9-/m0/s1
InChIKey TWVIFPUVMSKGQU-KZVJFYERSA-N
Mol Weight 199.68 g/mol
Molecular Formula C10H14ClNO
Exact Mass 199.076392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Hd2DtiKcWl
Name 2-exo-chloro-4-azahomoadamantan-5-one
Alternate Name(s) 5-Chloro-3-azatricyclo[4.3.1.1(3,8)]undecan-2-one
CAS Registry Number 103532-01-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14ClNO
InChI InChI=1S/C10H14ClNO/c11-9-5-12-4-6-1-7(9)3-8(2-6)10(12)13/h6-9H,1-5H2/t6-,7+,8-,9-/m0/s1
InChIKey TWVIFPUVMSKGQU-KZVJFYERSA-N
Molecular Weight 199.681 g/mol
SMILES C1(N2C[C@@]([C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])(Cl)[H])=O
SPLASH splash10-03dr-1900000000-a4e7a501e4f9a344d61b
Source of Spectrum F-41-3760-7
Wiley ID 1196619