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Anti-7-benzhydrylbicyclo[2.2.1]heptan-2-one
SpectraBase Compound ID 4TadVh8Qc0q
InChI InChI=1S/C20H20O/c21-18-13-16-11-12-17(18)20(16)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16-17,19-20H,11-13H2/t16-,17+,20?/m0/s1
InChIKey XGEBFESYVJIFER-UHFFFAOYSA-N
Mol Weight 276.38 g/mol
Molecular Formula C20H20O
Exact Mass 276.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fbi1impRosI
Name syn-7-Benzhydrylbicyclo[2.2.1]heptan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C20H20O
InChI InChI=1S/C20H20O/c21-18-13-16-11-12-17(18)20(16)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16-17,19-20H,11-13H2/t16-,17+,20?/m0/s1
InChIKey XGEBFESYVJIFER-UHFFFAOYSA-N
Molecular Weight 276.379 g/mol
SMILES C1([C@@]2(CC([C@]1(CC2)[H])=O)[H])C(c1ccccc1)c1ccccc1
SPLASH splash10-004i-0090000000-3bb2daa327c062ea8f0b
Source of Spectrum I-62-1763-0
Synonyms 7-benzhydrylbicyclo[2.2.1]heptan-2-one Anti-7-benzhydrylbicyclo[2.2.1]heptan-2-one
Wiley ID 1280674