Thiodiglycol bis(3-aminocrotonate)
7412
Reference
Thiodiglycol bis(3-aminocrotonate) Structure
Systematic / IUPAC Name: 2-{2-[(Z)-3-Aminobut-2-enoyl]oxyethylsulfanyl}ethyl (Z)-3-aminobut-2-enoate
ID: Reference7412
Other Names:
2-Butenoic acid,3-amino-,1,1'-(thiodi-2,1-ethanediyl)ester;
Sulfanediyldi-2,1-ethanediylbis(3-amino-2-butenoate)
Formula: C12H20N2O4S
Class: Extractables/Leachables
Spectral Data
Thiodiglycol bis(3-aminocrotonate) 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 | Orbitrap Fusion Lumos with ETD LBP FAIMS |
| No. of Spectral Trees | 1 |
| No. of Spectra | 162 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/28/2018 10:25:02 AM |
Identificators
| InChI | InChI=1S/C12H20N2O4S/c1-9(13)7-11(15)17-3-5-19-6-4-18-12(16)8-10(2)14/h7-8H,3-6,13-14H2,1-2H3/b9-7-,10-8- |
| InChI Key | GZVBGWRBVGVPLI-XOHWUJONSA-N |
| Canonical SMILES | CC(=CC(=O)OCCSCCOC(=O)C=C(C)N)N |
| CAS | 13560491 |
| Splash | |
| Other Names |
2-Butenoic acid,3-amino-,1,1'-(thiodi-2,1-ethanediyl)ester; Sulfanediyldi-2,1-ethanediylbis(3-amino-2-butenoate) |