| SpectraBase Spectrum ID |
GXnnXKGYSci |
| Name |
1-Propene-1,2,3-tricarboxylicacid,tributyl ester |
| CAS Registry Number |
7568-58-3 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
342.204238680 u |
| Formula |
C18H30O6 |
| InChI |
InChI=1S/C18H30O6/c1-4-7-10-22-16(19)13-15(18(21)24-12-9-6-3)14-17(20)23-11-8-5-2/h13H,4-12,14H2,1-3H3/b15-13- |
| InChIKey |
BANLNYYTSYHBAP-SQFISAMPSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
342.432 g/mol |
| Nominal Mass |
342 u |
| Quality |
961 |
| Retention Index |
2390 |
| SMILES |
C(\C(=C/C(OCCCC)=O)CC(OCCCC)=O)(OCCCC)=O |
| SPLASH |
splash10-0bt9-4910000000-2ef0cd2f7a8b437be242 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Tributyl-prop-1-ene-1,2,3-tricarboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026414 |
