Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

Chemical Info

InChI	InChI=1S/C18H16N2O3/c1-10-16-13(18(22)19-9-11-4-3-7-23-11)8-15(21)12-5-2-6-14(20-10)17(12)16/h2-7,13,20H,8-9H2,1H3,(H,19,22)
SMILES	O=C(C1CC(=O)c2c3c1c(C)[nH]c3ccc2)NCc1ccco1
InChI Key	QIROZZVNYLUVGF-UHFFFAOYSA-N
Molecular Formula	C18H16N2O3
Exact Mass	308.331 g/mol

Data and Resources

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Metadata Information

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Field	Value
DOI	10.14272/QIROZZVNYLUVGF-UHFFFAOYSA-N/CHMO0001148
License URL
Source	https://www.chemotion-repository.net/inchikey/QIROZZVNYLUVGF-UHFFFAOYSA-N/CHMO0001148
Version
Author	Andreas Link
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:07:04.682149
MetadataModified	2025-01-29T16:00:48.856939
MetadataPublished	2024-10-14
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear multiple bond coherence
Measurement Variables	temperature : 298.4 K PULPROG : hmbcgpndqf number of scans : 8 scans title : FP date : 20210819 starting time : 19.28 instrument : spect label : CWG-162 id : 112100 Solvent : DMSO

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