Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C33H32Br4/c1-21(34)25-5-13-29(14-6-25)33(30-15-7-26(8-16-30)22(2)35,31-17-9-27(10-18-31)23(3)36)32-19-11-28(12-20-32)24(4)37/h5-24H,1-4H3
SMILES CC(c1ccc(cc1)C(c1ccc(cc1)C(Br)C)(c1ccc(cc1)C(Br)C)c1ccc(cc1)C(Br)C)Br
InChI Key BKNFZNXZGIKBEB-UHFFFAOYSA-N
Molecular Formula C33H32Br4
Exact Mass 748.223 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BKNFZNXZGIKBEB-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/BKNFZNXZGIKBEB-UHFFFAOYSA-N/CHMO0000593
Version
Author Isabelle Wessely
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T03:36:37.718193
MetadataModified 2024-09-07T18:33:56.139663
MetadataPublished 2020-08-26
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
154573670 PubChem
The data in this table is sourced from UniChem at EBI.