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Cyclopropanecarboxylic acid, 2-(1,1-dimethylethoxy)-3-methyl-2-phenyl-, 1,1-dimethylethyl ester, (1.alpha.,2.alpha.,3.beta.)-

View entire compound with spectra: 1 MS (GC)

Cyclopropanecarboxylic acid, 2-(1,1-dimethylethoxy)-3-methyl-2-phenyl-, 1,1-dimethylethyl ester, (1.alpha.,2.alpha.,3.beta.)-
SpectraBase Compound ID 5IbHoAlRKe
InChI InChI=1S/C19H28O3/c1-13-15(16(20)21-17(2,3)4)19(13,22-18(5,6)7)14-11-9-8-10-12-14/h8-13,15H,1-7H3/t13-,15+,19+/m0/s1
InChIKey CGFIACWSTCODIV-ZBQZNYHESA-N
Mol Weight 304.43 g/mol
Molecular Formula C19H28O3
Exact Mass 304.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QUCX8wo3ZK
Name Cyclopropanecarboxylic acid, 2-(1,1-dimethylethoxy)-3-methyl-2-phenyl-, 1,1-dimethylethyl ester, (1.alpha.,2.alpha.,3.beta.)-
CAS Registry Number 58486-18-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O3
InChI InChI=1S/C19H28O3/c1-13-15(16(20)21-17(2,3)4)19(13,22-18(5,6)7)14-11-9-8-10-12-14/h8-13,15H,1-7H3/t13-,15+,19+/m0/s1
InChIKey CGFIACWSTCODIV-ZBQZNYHESA-N
Molecular Weight 304.430 g/mol
SMILES [C@@]1([C@](OC(C)(C)C)(c2ccccc2)[C@]1(C)[H])(C(OC(C)(C)C)=O)[H]
SPLASH splash10-052u-5900000000-f284e1062d0ea793c1f1
Source of Spectrum K-111-3889-0
Synonyms tert butyl ester of 2c-tert-butoxy-3t-methyl-2t-phenyl-1R-cyclopropancarboxylic acid tert-Butyl (1S,2S,3S)-2-tert-butoxy-3-methyl-2-phenylcyclopropanecarboxylate
Wiley ID 1306708