This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C18H12O4


Canonical SMILES:
Oc1ccc(cc1)C1=CC(=O)C(=C(C1=O)O)c1ccccc1
InChI:
InChI=1S/C18H12O4/c19-13-8-6-11(7-9-13)14-10-15(20)16(18(22)17(14)21)12-4-2-1-3-5-12/h1-10,19,22H
InChIKey:
HLFCRNGNTFLPPX-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2025-04-03This work is licensed under a Creative Commons Attribution 4.0 International License.

 

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR) 
Authors: Johannes Liermann1 - Carsten Wieder2,3 - Claudia Simon Sanchez2 - Rainer Wiechert1 - Karsten Andresen2 - Eckhard Thines2,3 - Till Opatz1 - Anja Schueffler3

1. Department Chemie, Johannes Gutenberg-Universität Mainz, Germany

2. Institute of Molecular Physiology (IMP), Johannes Gutenberg-Universität Mainz, Germany

3. Institut für Biotechnologie und Wirkstoff-Forschung, Institut für Biotechnologie und Wirkstoff-Forschung gGmbH, Germany

Analysis DOI:
Analysis ID:
Content:   
IR (ATR, ṽ) = 1660 (m), 1625 (s), 1607 (s), 1514 (vs), 1494 (vs), 1439 (s), 1365 (s), 1347 (s), 1308 (s), 1284 (s), 1232 (s), 1113 (m), 1024 (vs), 841 (m), 699 (m), 510 (m), 482 (m), 456 (m) cm–1.
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