Dataset
fast-atom bombardment mass spectrometry (FABMS)
Chemical Info
InChI | InChI=1S/C36H28OP2.C12H11N2S.Cu/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;1-15-12-6-4-10(5-7-12)14-9-11-3-2-8-13-11;/h1-28H;2-9H,1H3;/q;-1;+1/b;14-9+; |
---|---|
SMILES | c1ccc(cc1)P(c1ccccc1Oc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1.CSc1ccc(cc1)/N=C/c1cccn1[Cu] |
InChI Key | APOKKEJOTUSELA-WNLPKAFNSA-N |
Molecular Formula | C48H39CuN2OP2S |
Exact Mass | 817.395 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/APOKKEJOTUSELA-WNLPKAFNSA-N/CHMO0000563 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/APOKKEJOTUSELA-WNLPKAFNSA-N/CHMO0000563 |
Version | |
Author | Valentina Ferraro |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T03:15:49.559380 |
MetadataModified | 2024-09-08T03:15:49.559385 |
MetadataPublished | 2024-04-17 |
Field | Value |
---|---|
Measurement Technique | fast-atom bombardment mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
No additional information available for this Dataset. |