Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C32H33N3O2/c1-4-37-32(36)29-17-22(26-18-33-30-20(2)10-8-14-24(26)30)16-28(35(29)23-12-6-5-7-13-23)27-19-34-31-21(3)11-9-15-25(27)31/h5-15,18-19,22,28-29,33-34H,4,16-17H2,1-3H3/t22-,28-,29-/m0/s1
SMILES CCOC(=O)[C@@H]1C[C@H](C[C@H](N1c1ccccc1)c1c[nH]c2c1cccc2C)c1c[nH]c2c1cccc2C
InChI Key TVOSEASRHAEMSD-ZRKWFTTGSA-N
Molecular Formula C32H33N3O2
Exact Mass 491.623 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/TVOSEASRHAEMSD-ZRKWFTTGSA-N/NMR/13C/acetone/100
License URL
Source https://www.chemotion-repository.net/inchikey/TVOSEASRHAEMSD-ZRKWFTTGSA-N/NMR/13C/acetone/100
Version
Author Sabilla Zhong
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • ethyl (2S,4S,6S)-4,6-bis(7-methyl-1H-indol-3-yl)-1-phenylpiperidine-2-carboxylate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    73427458 PubChem
    The data in this table is sourced from UniChem at EBI.