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5-Chloro-2-nitromethyleneadamantane
SpectraBase Compound ID 3u5igihD1nX
InChI InChI=1S/C11H14ClNO2/c12-11-3-7-1-8(4-11)10(6-13(14)15)9(2-7)5-11/h6-9H,1-5H2/b10-6-/t7-,8-,9+,11-/m0/s1
InChIKey CMAVPOYAJDQJHH-JETDKADNSA-N
Mol Weight 227.69 g/mol
Molecular Formula C11H14ClNO2
Exact Mass 227.071306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPDEcJGtyiK
Name 5-Chloro-2-nitromethyleneadamantane
Alternate Name(s) 1-chloro-4-(nitromethylene)adamantane
Comments Less than 3 mono-isotopic peaks
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Formula C11H14ClNO2
InChI InChI=1S/C11H14ClNO2/c12-11-3-7-1-8(4-11)10(6-13(14)15)9(2-7)5-11/h6-9H,1-5H2/b10-6-/t7-,8-,9+,11-/m0/s1
InChIKey CMAVPOYAJDQJHH-JETDKADNSA-N
Molecular Weight 227.691 g/mol
SMILES [C@@]12(\C([C@@]3(C[C@](C[C@@](C2)(C3)[H])(C1)Cl)[H])=C\N(=O)=O)[H]
SPLASH splash10-0006-9000000000-882594650c8ed81faf9e
Source of Spectrum J-66-1990-16
Wiley ID 1534870