Dataset
fast-atom bombardment mass spectrometry (FABMS)
Chemical Info
InChI | InChI=1S/C34H31N/c1-22-4-14-28(15-5-22)32-21-30-24(3)18-23(2)19-33(30)35-34(32)31-20-27-11-10-25-6-8-26(9-7-25)12-16-29(31)17-13-27/h4-9,13-15,17-21H,10-12,16H2,1-3H3 |
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SMILES | Cc1ccc(cc1)c1cc2c(C)cc(cc2nc1c1cc2CCc3ccc(CCc1cc2)cc3)C |
InChI Key | WAFFUKHSOQTNTI-UHFFFAOYSA-N |
Molecular Formula | C34H31N |
Exact Mass | 453.617 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/WAFFUKHSOQTNTI-UHFFFAOYSA-N/CHMO0000563 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/WAFFUKHSOQTNTI-UHFFFAOYSA-N/CHMO0000563 |
Version | |
Author | Tilman Hans Köhler |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T03:33:28.643803 |
MetadataModified | 2024-09-08T03:33:28.643809 |
MetadataPublished | 2024-05-21 |
Field | Value |
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Measurement Technique | fast-atom bombardment mass spectrometry |
Measurement Variables |