Dataset

7_NMR_Methanol-d4-1.cosy

Chemical Info

molecular Image
InChI InChI=1S/C21H22O7/c1-21(2,26)7-6-12-14(22)9-16(24)18-19(25)13(10-28-20(12)18)11-4-5-17(27-3)15(23)8-11/h4-5,8-10,22-24,26H,6-7H2,1-3H3
SMILES COC1=CC=C(C2=COC3=C(CCC(C)(C)O)C(O)=CC(O)=C3C2=O)C=C1O
InChI Key NTQLDHPJSKJOIB-UHFFFAOYSA-N
Molecular Formula C21H22O7
Exact Mass 386.400 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p55.s293.d1701
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1701
Version
Author Çiçek SS, Galarza Pérez M, Wenzel-Storjohann A, Bezerra RM, Segovia JFO, Girreser U, Kanzaki I, Tasdemir D.
Maintainer
Language english
MetadataCreated 2024-04-22T16:15:33.961533
MetadataModified 2025-02-03T15:49:14.625704
MetadataPublished 2024-01-16 10:27:41
Related Molecule