Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C38H60N2O2/c1-27(2)33(41-39-35(5,6)23-13-24-36(39,7)8)31-19-15-29(16-20-31)30-17-21-32(22-18-30)34(28(3)4)42-40-37(9,10)25-14-26-38(40,11)12/h15-22,27-28,33-34H,13-14,23-26H2,1-12H3
SMILES	CC(C(c1ccc(cc1)c1ccc(cc1)C(C(C)C)ON1C(C)(C)CCCC1(C)C)ON1C(C)(C)CCCC1(C)C)C
InChI Key	KNHYSHHYDQXCMX-UHFFFAOYSA-N
Molecular Formula	C38H60N2O2
Exact Mass	576.895 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KNHYSHHYDQXCMX-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/KNHYSHHYDQXCMX-UHFFFAOYSA-N/CHMO0000470
Version
Author	Yannick Matt
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T03:41:38.893575
MetadataModified	2024-09-07T18:40:26.903646
MetadataPublished	2020-08-26

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
154573663	PubChem
The data in this table is sourced from UniChem at EBI.