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1-(m-Xylyl)-adamantane
SpectraBase Compound ID 26QdRq72tpz
InChI InChI=1S/C18H24/c1-12-3-4-17(13(2)5-12)18-9-14-6-15(10-18)8-16(7-14)11-18/h3-5,14-16H,6-11H2,1-2H3/t14-,15+,16-,18-
InChIKey DZWYAGKHGRPVNN-CMIRHGDUSA-N
Mol Weight 240.39 g/mol
Molecular Formula C18H24
Exact Mass 240.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HR4NhixLY66
Name 1-(m-Xylyl)-adamantane
Alternate Name(s) 1-(2,4-Dimethylphenyl)adamantane
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Formula C18H24
InChI InChI=1S/C18H24/c1-12-3-4-17(13(2)5-12)18-9-14-6-15(10-18)8-16(7-14)11-18/h3-5,14-16H,6-11H2,1-2H3/t14-,15+,16-,18-
InChIKey DZWYAGKHGRPVNN-CMIRHGDUSA-N
Molecular Weight 240.390 g/mol
SMILES C12(c3c(cc(cc3)C)C)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-0006-1690000000-2828333afc3d82e179f1
Source of Spectrum F5-3-1041-E
Wiley ID 1732226