Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C10H13ClO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,6H2,1-3H3
SMILES COc1cc(CCl)cc(c1OC)OC
InChI Key XXRUQNNAKXZSOS-UHFFFAOYSA-N
Molecular Formula C10H13ClO3
Exact Mass 216.661 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XXRUQNNAKXZSOS-UHFFFAOYSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/XXRUQNNAKXZSOS-UHFFFAOYSA-N/CHMO0001148
Version
Author Jana Alpin
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-04-13T02:13:34.814794
MetadataModified 2025-04-13T02:13:34.814799
MetadataPublished 2025-04-10
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