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t-Butyl [(1S,2R,3R)-2-heptyl-3-[2'-(p-methoxyphenyl)-2'-oxoethyl]cyclopropane-1-carboxylate
SpectraBase Compound ID 95QanAo8inC
InChI InChI=1S/C24H36O4/c1-6-7-8-9-10-11-19-20(22(19)23(26)28-24(2,3)4)16-21(25)17-12-14-18(27-5)15-13-17/h12-15,19-20,22H,6-11,16H2,1-5H3/t19-,20-,22-/m0/s1
InChIKey YWYLBBQVFSLDOA-ONTIZHBOSA-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 9z5EKHicTMu
Name t-Butyl [(1S,2R,3R)-2-heptyl-3-[2'-(p-methoxyphenyl)-2'-oxoethyl]cyclopropane-1-carboxylate
Alternate Name(s) t-Butyl [(1S,2S,3S)-2-heptyl-3-(2'-(p-methoxyphenyl)-2'-oxoethyl)]cyclopropane-1-carboxylate (1S,2S,3S)-tert-butyl 2-heptyl-3-(2-(4-methoxyphenyl)-2-oxoethyl)cyclopropanecarboxylate (1S,2S,3S)-2-heptyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1-cyclopropanecarboxylic acid tert-butyl ester tert-Butyl (1S,2S,3S)-2-heptyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]cyclopropane-1-carboxylate tert-Butyl (1S,2S,3S)-2-heptyl-3-[2-(4-methoxyphenyl)-2-oxo-ethyl]cyclopropanecarboxylate tert-Butyl (1S,2S,3S)-2-heptyl-3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]cyclopropane-1-carboxylate
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Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-6-7-8-9-10-11-19-20(22(19)23(26)28-24(2,3)4)16-21(25)17-12-14-18(27-5)15-13-17/h12-15,19-20,22H,6-11,16H2,1-5H3/t19-,20-,22-/m0/s1
InChIKey YWYLBBQVFSLDOA-ONTIZHBOSA-N
Molecular Weight 388.548 g/mol
SMILES [C@@]1([C@@](C(OC(C)(C)C)=O)([C@]1(CCCCCCC)[H])[H])(CC(c1ccc(cc1)OC)=O)[H]
SPLASH splash10-01q9-1219000000-473128354232159a817d
Source of Spectrum F5-4-327-5a
Wiley ID 1732673