Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C17H24BrNO/c1-3-5-8-17(20,9-6-4-2)15-11-13(18)12-16-14(15)7-10-19-16/h7,10-12,19-20H,3-6,8-9H2,1-2H3
SMILES	CCCCC(c1cc(Br)cc2c1cc[nH]2)(CCCC)O
InChI Key	IPVPMKZYBAWPHP-UHFFFAOYSA-N
Molecular Formula	C17H24BrNO
Exact Mass	338.283 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/IPVPMKZYBAWPHP-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/IPVPMKZYBAWPHP-UHFFFAOYSA-N/CHMO0000593
Version
Author	Niklas Krappel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:09:16.852157
MetadataModified	2024-09-08T01:09:16.852163
MetadataPublished	2023-07-31

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

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.