Dataset

fast-atom bombardment mass spectrometry (FABMS)

Chemical Info

InChI	InChI=1S/C36H29N/c1-2-8-34(9-3-1)37-36-24-31-16-14-25-10-12-26(13-11-25)15-17-32(36)23-35(31)30-19-18-29-20-27-6-4-5-7-28(27)21-33(29)22-30/h1-13,18-24,37H,14-17H2
SMILES	c1ccc(cc1)Nc1cc2CCc3ccc(CCc1cc2c1ccc2c(c1)cc1c(c2)cccc1)cc3
InChI Key	WWGWJDBVZPPBII-UHFFFAOYSA-N
Molecular Formula	C36H29N
Exact Mass	475.622 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/WWGWJDBVZPPBII-UHFFFAOYSA-N/CHMO0000563
License URL
Source	https://www.chemotion-repository.net/inchikey/WWGWJDBVZPPBII-UHFFFAOYSA-N/CHMO0000563
Version
Author	Christoph Zippel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:14:37.810570
MetadataModified	2024-09-08T00:11:25.631399
MetadataPublished	2023-01-04

Field	Value
Measurement Technique	fast-atom bombardment mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
138453832	PubChem
The data in this table is sourced from UniChem at EBI.