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(+-)-1-Ethoxy-r-1-phenyl-t-2-fluorobenzocycloheptane
SpectraBase Compound ID Nm80DjAsUA
InChI InChI=1S/C19H21FO/c1-2-21-19(16-11-4-3-5-12-16)17-13-7-6-9-15(17)10-8-14-18(19)20/h3-7,9,11-13,18H,2,8,10,14H2,1H3/t18-,19+/m1/s1
InChIKey QACPJQLTNXRDFM-MOPGFXCFSA-N
Mol Weight 284.37 g/mol
Molecular Formula C19H21FO
Exact Mass 284.157643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79mKULqMrg2
Name (+-)-1-Ethoxy-r-1-phenyl-t-2-fluorobenzocycloheptane
Alternate Name(s) (5S,6R)-5-Ethoxy-6-fluoro-5-phenyl-6,7,8,9-tetrahydro-5H-benzocycloheptene (5S,6R)-5-ethoxy-6-fluoro-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[a]cycloheptene Ethyl (5S,6R)-6-fluoro-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[a]cyclohepten-5-yl ether
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Formula C19H21FO
InChI InChI=1S/C19H21FO/c1-2-21-19(16-11-4-3-5-12-16)17-13-7-6-9-15(17)10-8-14-18(19)20/h3-7,9,11-13,18H,2,8,10,14H2,1H3/t18-,19+/m1/s1
InChIKey QACPJQLTNXRDFM-MOPGFXCFSA-N
Molecular Weight 284.374 g/mol
SMILES [C@@]1(c2c(CCC[C@]1(F)[H])cccc2)(c1ccccc1)OCC
SPLASH splash10-06sj-9720000000-46cc451be94e8e27c18f
Source of Spectrum F-50-12242-4
Wiley ID 789856