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1-Methyl hydrogen 8-(2-formyl-5-methoxyphenyl)non-2-enedioate
SpectraBase Compound ID 2fITlcGGpN4
InChI InChI=1S/C18H22O6/c1-23-14-10-9-13(12-19)16(11-14)15(18(21)22)7-5-3-4-6-8-17(20)24-2/h6,8-12,15H,3-5,7H2,1-2H3,(H,21,22)/b8-6+
InChIKey WQOBMRJUEPLORA-SOFGYWHQSA-N
Mol Weight 334.37 g/mol
Molecular Formula C18H22O6
Exact Mass 334.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9R0HJW0OQL
Name 1-Methyl hydrogen 8-(2-formyl-5-methoxyphenyl)non-2-enedioate
Alternate Name(s) (7E)-2-(2-formyl-5-methoxyphenyl)-9-methoxy-9-oxo-7-nonenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O6
InChI InChI=1S/C18H22O6/c1-23-14-10-9-13(12-19)16(11-14)15(18(21)22)7-5-3-4-6-8-17(20)24-2/h6,8-12,15H,3-5,7H2,1-2H3,(H,21,22)/b8-6+
InChIKey WQOBMRJUEPLORA-SOFGYWHQSA-N
Molecular Weight 334.368 g/mol
SMILES OC(C(c1c(ccc(c1)OC)C=O)CCCC\C=C\C(=O)OC)=O
SPLASH splash10-03di-0970000000-ec0ae9ce962aff3db158
Source of Spectrum KC-0-1934-31
Wiley ID 822815