high resolution fast-atom bombardment mass...
URL: https://www.chemotion-repository.net/inchikey/OCLGZDCBOFTXRM-PIACRFSQSA-N/CHMO0000726
Dataset description:
dataset for high resolution fast-atom bombardment mass spectrometry (HRFABMS)\n\n
Source: high resolution fast-atom bombardment mass spectrometry (HRFABMS)
Chemical Info
InChI | InChI=1S/C29H48O2/c1-16(2)26(30)20-13-19(20)17(3)22-7-8-23-21-14-25(31-6)29-15-18(29)9-12-28(29,5)24(21)10-11-27(22,23)4/h16-26,30H,7-15H2,1-6H3/t17-,18-,19-,20+,21+,22-,23+,24+,25-,26?,27-,28-,29+/m1/s1 |
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SMILES | CO[C@@H]1C[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@@]31C[C@H]3CC2)C)[C@@H]([C@H]1C[C@@H]1C(C(C)C)O)C |
InChI Key | OCLGZDCBOFTXRM-PIACRFSQSA-N |
Molecular Formula | C29H48O2 |
Exact Mass | 428.690 g/mol |
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Additional Information
Field | Value |
---|---|
Data last updated | September 7, 2024 |
Metadata last updated | September 7, 2024 |
Created | September 7, 2024 |
Format | HTML |
License | No License Provided |
Id | 46471c48-ff28-4430-8d48-19510103b816 |
Package id | 10-14272-oclgzdcboftxrm-piacrfsqsa-n-chmo0000726 |
Resource type | HTML |
State | active |