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mass spectrometry (MS)

URL: https://www.chemotion-repository.net/inchikey/XBMPWLBNOBSWSA-UHFFFAOYSA-N/CHMO0000470

Dataset description:

dataset for mass spectrometry (MS)\n\n

Source: mass spectrometry (MS)

Chemical Info

molecular Image

InChI	InChI=1S/C44H28N18/c45-57-51-37-17-5-31(6-18-37)43(32-7-19-38(20-8-32)52-58-46,33-9-21-39(22-10-33)53-59-47)29-1-2-30(4-3-29)44(34-11-23-40(24-12-34)54-60-48,35-13-25-41(26-14-35)55-61-49)36-15-27-42(28-16-36)56-62-50/h1-28H
SMILES	[N-]=[N+]=Nc1ccc(cc1)C(c1ccc(cc1)N=[N+]=[N-])(c1ccc(cc1)N=[N+]=[N-])c1ccc(cc1)C(c1ccc(cc1)N=[N+]=[N-])(c1ccc(cc1)N=[N+]=[N-])c1ccc(cc1)N=[N+]=[N-]
InChI Key	XBMPWLBNOBSWSA-UHFFFAOYSA-N
Molecular Formula	C44H28N18
Exact Mass	808.814 g/mol

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Additional Information

Field	Value
Data last updated	September 8, 2024
Metadata last updated	September 8, 2024
Created	September 8, 2024
Format	HTML
License	No License Provided
Id	2d39b578-9947-4e6a-904b-70a0a1f870c4
Package id	10-14272-xbmpwlbnobswsa-uhfffaoysa-n-chmo0000470
Resource type	HTML
State	active