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(cis)-[4'-Hydroxy-2'-cyclohexen-1'-yl]-(2'-methyl-2-propenyl)-propanedioic acid - Dimethyl ester
SpectraBase Compound ID 3yb3vQJ029U
InChI InChI=1S/C15H22O5/c1-10(2)9-15(13(17)19-3,14(18)20-4)11-5-7-12(16)8-6-11/h5,7,11-12,16H,1,6,8-9H2,2-4H3/t11-,12+/m1/s1
InChIKey LSOQHAWNRPFCNX-NEPJUHHUSA-N
Mol Weight 282.34 g/mol
Molecular Formula C15H22O5
Exact Mass 282.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVFJWMLVF4s
Name (cis)-[4'-Hydroxy-2'-cyclohexen-1'-yl]-(2'-methyl-2-propenyl)-propanedioic acid - Dimethyl ester
Alternate Name(s) Dimethyl 2-((1S,4R)-4-hydroxycyclohex-2-en-1-yl)-2-(2-methylallyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O5
InChI InChI=1S/C15H22O5/c1-10(2)9-15(13(17)19-3,14(18)20-4)11-5-7-12(16)8-6-11/h5,7,11-12,16H,1,6,8-9H2,2-4H3/t11-,12+/m1/s1
InChIKey LSOQHAWNRPFCNX-NEPJUHHUSA-N
Molecular Weight 282.336 g/mol
SMILES O[C@]1(C=C[C@@](C(C(=O)OC)(C(=O)OC)CC(=C)C)(CC1)[H])[H]
SPLASH splash10-006w-1910000000-38b02e00e146acaee13f
Source of Spectrum F5-6-3011-36b
Wiley ID 1733520