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Propanedioic acid, [[3-(methoxycarbonyl)-2-cyclohexen-1-yl]oxy]-, dimethyl ester, (.+-.)-
SpectraBase Compound ID LKYp6Nr7Hx9
InChI InChI=1S/C13H18O7/c1-17-11(14)8-5-4-6-9(7-8)20-10(12(15)18-2)13(16)19-3/h7,9-10H,4-6H2,1-3H3
InChIKey PVFWNBSGNGXQLT-UHFFFAOYSA-N
Mol Weight 286.28 g/mol
Molecular Formula C13H18O7
Exact Mass 286.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KhipuAbRNW
Name Propanedioic acid, [[3-(methoxycarbonyl)-2-cyclohexen-1-yl]oxy]-, dimethyl ester, (.+-.)-
CAS Registry Number 106093-98-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O7
InChI InChI=1S/C13H18O7/c1-17-11(14)8-5-4-6-9(7-8)20-10(12(15)18-2)13(16)19-3/h7,9-10H,4-6H2,1-3H3
InChIKey PVFWNBSGNGXQLT-UHFFFAOYSA-N
Molecular Weight 286.280 g/mol
SMILES C(C(=O)OC)(C(=O)OC)OC1C=C(C(=O)OC)CCC1
SPLASH splash10-0a59-0900000000-0b581c367ceb4180a0ba
Source of Spectrum C-109-1182-0
Synonyms 3-[bis(methoxycarbonyl)methoxy]-1-cyclohexenecarboxylic acid methyl ester Dimethyl 2-{[3-(methoxycarbonyl)-2-cyclohexen-1-yl]oxy}malonate
Wiley ID 1289463