Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C22H20ClNO/c1-22(2)16-8-4-6-10-19(16)24(20-11-7-5-9-17(20)22)15-12-13-21(25-3)18(23)14-15/h4-14H,1-3H3
SMILES	COc1ccc(cc1Cl)N1c2ccccc2C(c2c1cccc2)(C)C
InChI Key	ULGWFAYNZHAPTG-UHFFFAOYSA-N
Molecular Formula	C22H20ClNO
Exact Mass	349.853 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ULGWFAYNZHAPTG-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/ULGWFAYNZHAPTG-UHFFFAOYSA-N/CHMO0000593
Version
Author	Zhen Zhang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T03:56:17.894275
MetadataModified	2024-09-07T18:59:29.540639
MetadataPublished	2020-10-26
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
154723627	PubChem
The data in this table is sourced from UniChem at EBI.