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t-Butyl [(1R,2R,3R)-3-heptyl-3-[2'-(2''-methoxyphenyl)oxoethyl]cyclopropane-2-carboxylate
SpectraBase Compound ID EUL976MunAY
InChI InChI=1S/C24H36O4/c1-6-7-8-9-10-13-17-19(22(17)23(26)28-24(2,3)4)16-20(25)18-14-11-12-15-21(18)27-5/h11-12,14-15,17,19,22H,6-10,13,16H2,1-5H3/t17-,19-,22-/m0/s1
InChIKey OKBQFGYUFWSGHO-JLMWRMLUSA-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 DOuRaXjii80
Name t-Butyl [(1R,2R,3R)-3-heptyl-3-[2'-(2''-methoxyphenyl)oxoethyl]cyclopropane-2-carboxylate
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Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-6-7-8-9-10-13-17-19(22(17)23(26)28-24(2,3)4)16-20(25)18-14-11-12-15-21(18)27-5/h11-12,14-15,17,19,22H,6-10,13,16H2,1-5H3/t17-,19-,22-/m0/s1
InChIKey OKBQFGYUFWSGHO-JLMWRMLUSA-N
Molecular Weight 388.548 g/mol
SMILES [C@@]1([C@@](C(OC(C)(C)C)=O)([C@]1(CCCCCCC)[H])[H])(CC(c1c(OC)cccc1)=O)[H]
SPLASH splash10-000i-2922000000-595ef3a30e117759cfdb
Source of Spectrum F5-4-327-5b
Synonyms t-Butyl [(1S,2S,3S)-3-heptyl-1-(2'-(2''-methoxyphenyl)oxoethyl)]cyclopropane-2-carboxylate (1S,2S,3S)-tert-butyl 2-heptyl-3-(2-(2-methoxyphenyl)-2-oxoethyl)cyclopropanecarboxylate (1S,2S,3S)-2-heptyl-3-[2-(2-methoxyphenyl)-2-oxoethyl]-1-cyclopropanecarboxylic acid tert-butyl ester tert-Butyl (1S,2S,3S)-2-heptyl-3-[2-(2-methoxyphenyl)-2-oxoethyl]cyclopropane-1-carboxylate tert-Butyl (1S,2S,3S)-2-heptyl-3-[2-(2-methoxyphenyl)-2-oxo-ethyl]cyclopropanecarboxylate tert-Butyl (1S,2S,3S)-2-heptyl-3-[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl]cyclopropane-1-carboxylate
Wiley ID 1732671