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Cyclopentanecarboxylic acid,3-butoxy-4-(1-methylethenyl)-,1,1-dimethylethyl ester (1.alpha.,3.beta.,4.beta.)-
SpectraBase Compound ID QWT6IzK9DF
InChI InChI=1S/C17H30O3/c1-7-8-9-19-15-11-13(10-14(15)12(2)3)16(18)20-17(4,5)6/h13-15H,2,7-11H2,1,3-6H3/t13-,14+,15+/m0/s1
InChIKey UMVLBCVLBLBLJO-RRFJBIMHSA-N
Mol Weight 282.42 g/mol
Molecular Formula C17H30O3
Exact Mass 282.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OpdMr7sgSE
Name Cyclopentanecarboxylic acid,3-butoxy-4-(1-methylethenyl)-,1,1-dimethylethyl ester (1.alpha.,3.beta.,4.beta.)-
Alternate Name(s) Cyclopentanecarboxylic acid,3-butoxy-4-(1-methylethenyl)-,1,1-dimethylethyl ester (1.beta.,3.alpha.,4.alpha.)- tert-butyl (1S,3R,4R)-3-butoxy-4-isopropenylcyclopentanecarboxylate
CAS Registry Number 137328-40-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O3
InChI InChI=1S/C17H30O3/c1-7-8-9-19-15-11-13(10-14(15)12(2)3)16(18)20-17(4,5)6/h13-15H,2,7-11H2,1,3-6H3/t13-,14+,15+/m0/s1
InChIKey UMVLBCVLBLBLJO-RRFJBIMHSA-N
Molecular Weight 282.424 g/mol
SMILES C([C@]1(C[C@](C(=C)C)([C@@](C1)(OCCCC)[H])[H])[H])(OC(C)(C)C)=O
SPLASH splash10-004i-0090000000-f94b48296ba8209a7fa6
Source of Spectrum J-57-109-20
Wiley ID 1286186