Systematic / IUPAC Name: 5-Henicosylbenzene-1,3-diol
ID: Reference7668
Other Names:
5-Heneicosylresorcinol;
1,3-Benzenediol, 5-heneicosyl-;
5-Heneicosyl-1,3-benzenediol
Formula: C27H48O2
5-Henicosyl-1,3-benzenediol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 134 |
Tandem Spectra | MS1, MS2, MS3 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 3/29/2018 11:48:53 AM |
InChI | InChI=1S/C27H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-26(28)24-27(29)23-25/h22-24,28-29H,2-21H2,1H3 |
InChI Key | BLHLKJLSYHEOGY-UHFFFAOYSA-N |
Canonical SMILES | CCCCCCCCCCCCCCCCCCCCCC1=CC(=CC(=C1)O)O |
CAS | |
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Other Names |
5-Heneicosylresorcinol; 1,3-Benzenediol, 5-heneicosyl-; 5-Heneicosyl-1,3-benzenediol |
ChEMBL | CHEMBL1795554 |
ChemSpider | 136952 |
HMDb | HMDB31035 |
PubChem | 155461 |
ChemIDPlus | 070110597 |