Dataset
Arbutin.hsqc
Chemical Info
InChI | InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9+,10+,11+,12+/m1/s1 |
---|---|
SMILES | OC[C@H]1O[C@H](OC2=CC=C(O)C=C2)[C@@H](O)[C@@H](O)[C@H]1O |
InChI Key | BJRNKVDFDLYUGJ-DGORSVRFSA-N |
Molecular Formula | C12H16O7 |
Exact Mass | 272.250 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.57992/nmrxiv.p44.s264.d1535 |
License URL | https://creativecommons.org/licenses/by/4.0/legalcode |
Source | https://nmrxiv.org/D1535 |
Version | |
Author | Corinna Dietrich, Viola Munzert, Klaus‐Peter Zeller, Hans‐Ullrich Siehl, Stefan Berger, Dieter Sicker |
Maintainer | |
Language | english |
MetadataCreated | 2024-04-22T16:12:09.444334 |
MetadataModified | 2024-09-23T09:32:16.360597 |
MetadataPublished | 2023-12-25 01:25:29 |
Field | Value |
---|---|
Measurement Technique | heteronuclear single quantum coherence |
Measurement Variables |
|
Data-Source Molecule ID | Data-Source |
---|---|
No additional information available for this Dataset. |