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(1R,2R)-Methyl 5-(1,5-Dimethylhex-4-enyl)-2-oxocyclopentanecarboxylate isomer
SpectraBase Compound ID D2bhU5JreHN
InChI InChI=1S/C15H24O3/c1-10(2)6-5-7-11(3)12-8-9-13(16)14(12)15(17)18-4/h6,11-12,14H,5,7-9H2,1-4H3/t11-,12?,14-/m1/s1
InChIKey XAPAGRJQASSPLP-YXHCSQSYSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7AGFTQLnk6c
Name (1R,2R)-Methyl 5-(1,5-Dimethylhex-4-enyl)-2-oxocyclopentanecarboxylate isomer
Alternate Name(s) Methyl (1R)-2-[(1R)-1,5-dimethyl-4-hexenyl]-5-oxocyclopentanecarboxylate Methyl 5-(1,5-Dimethylhex-4-enyl)-2-oxocyclopentanecarboxylate isomer
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Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-10(2)6-5-7-11(3)12-8-9-13(16)14(12)15(17)18-4/h6,11-12,14H,5,7-9H2,1-4H3/t11-,12?,14-/m1/s1
InChIKey XAPAGRJQASSPLP-YXHCSQSYSA-N
Molecular Weight 252.354 g/mol
SMILES [C@@]1(C(CCC1=O)[C@@](CCC=C(C)C)(C)[H])(C(=O)OC)[H]
SPLASH splash10-052f-3900000000-ac1a96e375cb28cdef2c
Source of Spectrum J-66-950-2
Wiley ID 1534482