Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C32H12N20.Zn/c33-49-45-13-1-5-17-21(9-13)29-37-25(17)41-30-22-10-14(46-50-34)2-6-18(22)27(38-30)43-32-24-12-16(48-52-36)4-8-20(24)28(40-32)44-31-23-11-15(47-51-35)3-7-19(23)26(39-31)42-29;/h1-12H;/q-2;+2
SMILES	[N-]=[N+]=Nc1ccc2c(c1)C1=N/C/2=N\c2n3[Zn]n4/c(=N\1)/c1ccc(cc1/c/4=N/C1=N/C(=N\c3c3c2cc(N=[N+]=[N-])cc3)/c2c1ccc(c2)N=[N+]=[N-])N=[N+]=[N-]
InChI Key	OTSOKOBLYDZRBG-UHFFFAOYSA-N
Molecular Formula	C32H12N20Zn
Exact Mass	741.952 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/OTSOKOBLYDZRBG-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/OTSOKOBLYDZRBG-UHFFFAOYSA-N/CHMO0000470
Version
Author	Yannick Matt
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:27:48.573565
MetadataModified	2024-09-08T00:27:57.006207
MetadataPublished	2023-03-01

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
166638636	PubChem
The data in this table is sourced from UniChem at EBI.