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This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C6H10O4
Canonical SMILES: COC(=O)CCC(=O)OC
InChI: InChI=1S/C6H10O4/c1-9-5(7)3-4-6(8)10-2/h3-4H2,1-2H3
InChIKey: MUXOBHXGJLMRAB-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2024-08-07
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Author: Grace Hunt1
1. Newcastle University, United Kingdom
Analysis DOI:
Analysis ID:
Datasets