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

Formula: C13H14O3


Canonical SMILES:
COC(=O)c1ccc2c(c1)C=CC(O2)(C)C
InChI:
InChI=1S/C13H14O3/c1-13(2)7-6-9-8-10(12(14)15-3)4-5-11(9)16-13/h4-8H,1-3H3
InChIKey:
BVQOOKUOYKXECX-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2024-11-26This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

infrared absorption spectroscopy (IR) 
Authors: Sylvia Vanderheiden-Schroen1 - Nicole Volz2

1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany

2. Institute of Organic Chemistry, Karlsruher Institut für Technologie, Germany

Analysis DOI:
Analysis ID:
Content:   
IR (ATR, ṽ) = 2976 (w), 2951 (w), 1713 (vs), 1639 (w), 1608 (m), 1575 (w), 1489 (m), 1463 (w), 1439 (s), 1384 (w), 1366 (m), 1320 (w), 1288 (vs), 1271 (vs), 1228 (s), 1213 (s), 1191 (vs), 1164 (vs), 1123 (vs), 1113 (vs), 1095 (vs), 987 (m), 958 (s), 932 (m), 912 (m), 882 (m), 847 (m), 836 (m), 806 (w), 762 (vs), 704 (m), 618 (m), 598 (w), 526 (w), 504 (w), 448 (w), 421 (w), 397 (w), 384 (w) cm–1.
Datasets