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Methyl cis-1,2-Dimethyl-2-(4-methylphenyl)cyclopentanecarboxylate
SpectraBase Compound ID CC9qeazoMSs
InChI InChI=1S/C16H22O2/c1-12-6-8-13(9-7-12)15(2)10-5-11-16(15,3)14(17)18-4/h6-9H,5,10-11H2,1-4H3/t15-,16+/m1/s1
InChIKey PXIQLLNKNCNOCC-CVEARBPZSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sRLLGhYRrG
Name Methyl cis-1,2-Dimethyl-2-(4-methylphenyl)cyclopentanecarboxylate
Alternate Name(s) Methyl (cis)-1,2-dimethyl-2-(4'-methylphenyl)cyclopentane-1-carboxylate Methyl (1R,2R)-1,2-dimethyl-2-(4-methylphenyl)cyclopentanecarboxylate
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Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-12-6-8-13(9-7-12)15(2)10-5-11-16(15,3)14(17)18-4/h6-9H,5,10-11H2,1-4H3/t15-,16+/m1/s1
InChIKey PXIQLLNKNCNOCC-CVEARBPZSA-N
Molecular Weight 246.350 g/mol
SMILES [C@]1([C@@](c2ccc(cc2)C)(CCC1)C)(C(=O)OC)C
SPLASH splash10-05nk-0910000000-388efe3f364529023431
Source of Spectrum F-54-8137-18
Wiley ID 807824