SpectraBase Compound ID | 5McRaMKF1ma |
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InChI | InChI=1S/C9H8O4/c1-13-9(12)7-4-2-6(3-5-7)8(10)11/h2-5H,1H3,(H,10,11) |
InChIKey | REIDAMBAPLIATC-UHFFFAOYSA-N |
Mol Weight | 180.16 g/mol |
Molecular Formula | C9H8O4 |
Exact Mass | 180.042259 g/mol |
SpectraBase Spectrum ID | GxmFnTaK2kz |
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Name | 1,4-Benzenedicarboxylic acid, monomethyl ester |
CAS Registry Number | 1679-64-7 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C9H8O4 |
InChI | InChI=1S/C9H8O4/c1-13-9(12)7-4-2-6(3-5-7)8(10)11/h2-5H,1H3,(H,10,11) |
InChIKey | REIDAMBAPLIATC-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 A |
Purity | slightly to heavily contaminated |
Technique | KBr-Pellet |