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Terephthalic acid ethyl methyl ester
SpectraBase Compound ID 56ZRb4NK05L
InChI InChI=1S/C11H12O4/c1-3-15-11(13)9-6-4-8(5-7-9)10(12)14-2/h4-7H,3H2,1-2H3
InChIKey SGPZSOQUJLFTMQ-UHFFFAOYSA-N
Mol Weight 208.21 g/mol
Molecular Formula C11H12O4
Exact Mass 208.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pBnKU9JnHm
Name MPPP-M (p-dicarboxy-) ETME @
CAS Registry Number 22163-52-6
Classification Designer drug
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Exact Mass 208.073558862 u
Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-3-15-11(13)9-6-4-8(5-7-9)10(12)14-2/h4-7H,3H2,1-2H3
InChIKey SGPZSOQUJLFTMQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 208.213 g/mol
SMILES c1cc(ccc1C(OC)=O)C(OCC)=O
SPLASH splash10-03di-1900000000-f6646234dd9e903b4049
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Terephthalic acid ethyl methyl ester
Technique GC/MS
Wiley ID MMPW6e_6493