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CIS-(+/-)-TERT.-BUTYL-2-(2-OXO-2-PHENYLETHYL)-3-PHENYLCYCLOPROPANE-1-CARBOXYLATE

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CIS-(+/-)-TERT.-BUTYL-2-(2-OXO-2-PHENYLETHYL)-3-PHENYLCYCLOPROPANE-1-CARBOXYLATE
SpectraBase Compound ID LjLbqbJJOgC
InChI InChI=1S/C22H24O3/c1-22(2,3)25-21(24)20-17(19(20)16-12-8-5-9-13-16)14-18(23)15-10-6-4-7-11-15/h4-13,17,19-20H,14H2,1-3H3/t17-,19-,20-/m0/s1
InChIKey SKSQHAMRLCMEJK-IHPCNDPISA-N
Mol Weight 336.43 g/mol
Molecular Formula C22H24O3
Exact Mass 336.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41RR5emk2ey
Name (1S,2S,3S)-2-phenacyl-3-phenyl-1-cyclopropanecarboxylic acid tert-butyl ester
Alternate Name(s) (1S,2S,3S)-2-phenacyl-3-phenyl-cyclopropanecarboxylic acid tert-butyl ester tert-Butyl (1S,2S,3S)-2-phenacyl-3-phenyl-cyclopropane-1-carboxylate tert-Butyl (1S,2S,3S)-2-phenacyl-3-phenyl-cyclopropanecarboxylate
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Formula C22H24O3
InChI InChI=1S/C22H24O3/c1-22(2,3)25-21(24)20-17(19(20)16-12-8-5-9-13-16)14-18(23)15-10-6-4-7-11-15/h4-13,17,19-20H,14H2,1-3H3/t17-,19-,20-/m0/s1
InChIKey SKSQHAMRLCMEJK-IHPCNDPISA-N
Molecular Weight 336.431 g/mol
SMILES [C@]1([C@](CC(=O)c2ccccc2)([H])[C@@]1(c1ccccc1)[H])(C(OC(C)(C)C)=O)[H]
SPLASH splash10-0a4i-8910000000-32bfcaedcaf93c62f14c
Source of Spectrum J-66-7964-8
Wiley ID 1568571