Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C27H40N4O4/c1-4-6-10-15-30-18-23(32)28-21(17-20-12-8-7-9-13-20)25(33)29-24(19(3)5-2)27(35)31-16-11-14-22(31)26(30)34/h7-9,12-13,19,21-22,24H,4-6,10-11,14-18H2,1-3H3,(H,28,32)(H,29,33)/t19?,21-,22+,24-/m0/s1
SMILES CCCCCN1CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N2[C@@H](C1=O)CCC2)C(CC)C
InChI Key CDDIRVMOVZNUSI-ILJWHODDSA-N
Molecular Formula C27H40N4O4
Exact Mass 484.631 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CDDIRVMOVZNUSI-ILJWHODDSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/CDDIRVMOVZNUSI-ILJWHODDSA-N/CHMO0001150
Version
Author Claudine Herlan
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:06:22.541399
MetadataModified 2024-09-07T20:29:33.834960
MetadataPublished 2021-09-23
Related Molecule
Field Value
Measurement Technique 1H–1H correlation spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
156599661 PubChem
The data in this table is sourced from UniChem at EBI.