BNX 1077
2671
Reference
BNX 1077 Structure
Systematic / IUPAC Name: Tridecyl 3-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]propanoate
ID: Reference2671
Other Names: Tridecyl-3-(3,5-di tert-butyl-4-hydroxyphenyl) propionate
Formula: C30H52O3
Class: Extractables/Leachables Industrial Chemicals
Spectral Data
BNX 1077 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 88 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | APCI |
| Analyzers | FT |
| Last Modification | 3/16/2016 1:35:08 PM |
Identificators
| InChI | InChI=1S/C30H52O3/c1-8-9-10-11-12-13-14-15-16-17-18-21-33-27(31)20-19-24-22-25(29(2,3)4)28(32)26(23-24)30(5,6)7/h22-23,32H,8-21H2,1-7H3 |
| InChI Key | POHDYPLISNZLAR-UHFFFAOYSA-N |
| Canonical SMILES | CCCCCCCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C |
| CAS | 847488624 |
| Splash | |
| Other Names | Tridecyl-3-(3,5-di tert-butyl-4-hydroxyphenyl) propionate |