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Propanedioic acid, [[7-[2-methoxy-1-(methoxycarbonyl)-2-oxoethyl]-1-cyclohepten-1-yl]methyl]-, dimethyl ester
SpectraBase Compound ID KNIbkX2xxDi
InChI InChI=1S/C18H26O8/c1-23-15(19)13(16(20)24-2)10-11-8-6-5-7-9-12(11)14(17(21)25-3)18(22)26-4/h8,12-14H,5-7,9-10H2,1-4H3
InChIKey ZYZUXJDUSSTMNG-UHFFFAOYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C18H26O8
Exact Mass 370.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWBrZ8H5izP
Name Propanedioic acid, [[7-[2-methoxy-1-(methoxycarbonyl)-2-oxoethyl]-1-cyclohepten-1-yl]methyl]-, dimethyl ester
Alternate Name(s) Dimethyl 2-({7-[2-methoxy-1-(methoxycarbonyl)-2-oxoethyl]-1-cyclohepten-1-yl}methyl)malonate Dimethyl[[7-[2-methoxy-1-(methoxycarbonyl)-2-oxo-ethyl]-1-cyclohepten-1-yl]methyl]propanedioate
CAS Registry Number 110576-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O8
InChI InChI=1S/C18H26O8/c1-23-15(19)13(16(20)24-2)10-11-8-6-5-7-9-12(11)14(17(21)25-3)18(22)26-4/h8,12-14H,5-7,9-10H2,1-4H3
InChIKey ZYZUXJDUSSTMNG-UHFFFAOYSA-N
Molecular Weight 370.398 g/mol
SMILES C(CC=1C(C(C(=O)OC)C(=O)OC)CCCCC1)(C(=O)OC)C(=O)OC
SPLASH splash10-0a5c-2910000000-9ec4c5d16d2308ead162
Source of Spectrum J-54-6061-4
Wiley ID 1354122