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t-Butyl [(1R,2S,3R)-3-(p-methoxyphenyl)-1-(2'-heptyloxoethyl)]cyclopropane-2-carboxylate
SpectraBase Compound ID 5DpDFido4l3
InChI InChI=1S/C24H36O4/c1-6-7-8-9-10-11-18(25)16-20-21(17-12-14-19(27-5)15-13-17)22(20)23(26)28-24(2,3)4/h12-15,20-22H,6-11,16H2,1-5H3/t20-,21-,22+/m1/s1
InChIKey DIYCKLTUOWGSEK-VSKRKVRLSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Sl2rVfXDhH
Name t-Butyl [(1R,2S,3R)-3-(p-methoxyphenyl)-1-(2'-heptyloxoethyl)]cyclopropane-2-carboxylate
Alternate Name(s) t-Butyl [(1R,2S,3S)-2'-heptyl-3-(p-methoxyphenyl)-1-(2'-heptyloxoethyl)cyclopropane-2-carboxylate (1S,2R,3R)-tert-butyl 2-(4-methoxyphenyl)-3-(2-oxononyl)cyclopropanecarboxylate (1S,2R,3R)-2-(4-methoxyphenyl)-3-(2-oxononyl)-1-cyclopropanecarboxylic acid tert-butyl ester tert-Butyl (1S,2R,3R)-2-(4-methoxyphenyl)-3-(2-oxononyl)cyclopropane-1-carboxylate tert-Butyl (1S,2R,3R)-2-(4-methoxyphenyl)-3-(2-oxononyl)cyclopropanecarboxylate tert-Butyl (1S,2R,3R)-2-(4-methoxyphenyl)-3-(2-oxidanylidenenonyl)cyclopropane-1-carboxylate
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Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-6-7-8-9-10-11-18(25)16-20-21(17-12-14-19(27-5)15-13-17)22(20)23(26)28-24(2,3)4/h12-15,20-22H,6-11,16H2,1-5H3/t20-,21-,22+/m1/s1
InChIKey DIYCKLTUOWGSEK-VSKRKVRLSA-N
Molecular Weight 388.548 g/mol
SMILES [C@]1([C@](CC(=O)CCCCCCC)([C@]1(c1ccc(OC)cc1)[H])[H])(C(OC(C)(C)C)=O)[H]
SPLASH splash10-014i-9533000000-cfbe8276ea5f551f0103
Source of Spectrum F5-4-327-9a
Wiley ID 1732672