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/C9H18O5S/c1-4(2)15-9-8(13)7(12)6(11)5(3-10)14-9/h4-13H,3H2,1-2H3/t5-,6+,7+,8-,9+/m1/s1
SMILES OC[C@H]1O[C@@H](SC(C)C)[C@@H]([C@H]([C@H]1O)O)O
InChI Key BPHPUYQFMNQIOC-NXRLNHOXSA-N
Molecular Formula C9H18O5S
Exact Mass 238.301 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BPHPUYQFMNQIOC-NXRLNHOXSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/BPHPUYQFMNQIOC-NXRLNHOXSA-N/CHMO0001148
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-01-29T10:21:07.447397
MetadataModified 2025-01-29T16:14:17.192882
MetadataPublished 2024-11-08
Related Molecule