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(1S,2S,3S)-2-methyl-3-phenacyl-1-cyclopropanecarboxylic acid tert-butyl ester
SpectraBase Compound ID 5hMs5ZGA3N7
InChI InChI=1S/C17H22O3/c1-11-13(15(11)16(19)20-17(2,3)4)10-14(18)12-8-6-5-7-9-12/h5-9,11,13,15H,10H2,1-4H3/t11-,13-,15-/m0/s1
InChIKey KXRJTWAFZCUPCU-WHOFXGATSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrV3BO4BgP1
Name (1S,2S,3S)-2-methyl-3-phenacyl-1-cyclopropanecarboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-11-13(15(11)16(19)20-17(2,3)4)10-14(18)12-8-6-5-7-9-12/h5-9,11,13,15H,10H2,1-4H3/t11-,13-,15-/m0/s1
InChIKey KXRJTWAFZCUPCU-WHOFXGATSA-N
Molecular Weight 274.360 g/mol
SMILES [C@@]1([C@](C(OC(C)(C)C)=O)([H])[C@]1(C)[H])(CC(=O)c1ccccc1)[H]
SPLASH splash10-0zfr-3390000000-a6d7803ac9c594f7526b
Source of Spectrum J-66-7965-7
Synonyms (1S,2S,3S)-2-methyl-3-phenacyl-cyclopropanecarboxylic acid tert-butyl ester tert-Butyl (1S,2S,3S)-2-methyl-3-phenacyl-cyclopropane-1-carboxylate tert-Butyl (1S,2S,3S)-2-methyl-3-phenacyl-cyclopropanecarboxylate
Wiley ID 1568559