Dataset

fast-atom bombardment mass spectrometry (FABMS)

Chemical Info

InChI	InChI=1S/C29H30N3.C18H15P.ClH.Pd/c1-2-6-25(7-3-1)30-29-28(31-27-8-4-5-19-32(27)29)26-20-23-14-13-21-9-11-22(12-10-21)15-17-24(26)18-16-23;1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h4-5,8-12,16,18-19,25,30H,1-3,6-7,13-15,17H2;1-15H;1H;/q;;;+1/p-1
SMILES	c1ccc(cc1)P(c1ccccc1)c1ccccc1.Cl[Pd]c1c2CCc3ccc(CCc(c1c1nc4n(c1NC1CCCCC1)cccc4)cc2)cc3
InChI Key	LRHQVSJDOPYCOR-UHFFFAOYSA-M
Molecular Formula	C47H45ClN3PPd
Exact Mass	824.727 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/LRHQVSJDOPYCOR-UHFFFAOYSA-M/CHMO0000563
License URL
Source	https://www.chemotion-repository.net/inchikey/LRHQVSJDOPYCOR-UHFFFAOYSA-M/CHMO0000563
Version
Author	Mareen Stahlberger
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:58:30.318883
MetadataModified	2024-09-07T22:30:52.927759
MetadataPublished	2022-07-25

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

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