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.alpha.-(1-Chloroadamant-2-yl)acetophenone
SpectraBase Compound ID 7tbmP23o0ed
InChI InChI=1S/C18H21ClO/c19-18-10-12-6-13(11-18)8-15(7-12)16(18)9-17(20)14-4-2-1-3-5-14/h1-5,12-13,15-16H,6-11H2/t12-,13+,15-,16?,18-
InChIKey PWSWATGRLHHAOT-JOWXDBPVSA-N
Mol Weight 288.82 g/mol
Molecular Formula C18H21ClO
Exact Mass 288.128093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdDsf9La8Pb
Name .alpha.-(1-Chloroadamant-2-yl)acetophenone
Alternate Name(s) 2-(1-Chloro-2-adamantyl)-1-phenylethanone
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Formula C18H21ClO
InChI InChI=1S/C18H21ClO/c19-18-10-12-6-13(11-18)8-15(7-12)16(18)9-17(20)14-4-2-1-3-5-14/h1-5,12-13,15-16H,6-11H2/t12-,13+,15-,16?,18-
InChIKey PWSWATGRLHHAOT-JOWXDBPVSA-N
Molecular Weight 288.818 g/mol
SMILES [C@]12(C([C@@]3(C[C@](C2)(C[C@](C1)(C3)[H])[H])[H])CC(=O)c1ccccc1)Cl
SPLASH splash10-0pb9-4960000000-df69ada5d0920d7df3af
Source of Spectrum J-64-5831-14
Wiley ID 1530818