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tert-Butyl (1R,2R)-1-acetyl-2-(4-methoxyphenyl)cyclopropane-1-carboxylate
SpectraBase Compound ID 1zKLp1buvqy
InChI InChI=1S/C17H22O4/c1-11(18)17(15(19)21-16(2,3)4)10-14(17)12-6-8-13(20-5)9-7-12/h6-9,14H,10H2,1-5H3/t14-,17+/m1/s1
InChIKey JPQVQORNQRTRDI-PBHICJAKSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2kyAf8RKRc
Name tert-Butyl (1R,2R)-1-acetyl-2-(4-methoxyphenyl)cyclopropane-1-carboxylate
Appearance Colorless oil
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Exact Mass 290.151809184 u
Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-11(18)17(15(19)21-16(2,3)4)10-14(17)12-6-8-13(20-5)9-7-12/h6-9,14H,10H2,1-5H3/t14-,17+/m1/s1
InChIKey JPQVQORNQRTRDI-PBHICJAKSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804614
Quality 251
Reported Formula C17H22O4
SMILES C1=CC(=CC=C1OC)[C@@]1([C@@](C1)(C(=O)OC(C)(C)C)C(C)=O)[H]
SPLASH splash10-0gc1-1980000000-094b7bab150bf76bc282
Sample Comments dr = 1.2:1
Source of Spectrum ACI-57-SM11-1f (DOI: 10.1002/anie.201804614)
Thin-Layer Chromatography 0.60 (petroleum ether/EtOAc, 9:1)
Wiley ID 1893023