| SpectraBase Spectrum ID |
DkIjW8hFRaa |
| Name |
1,4-Butanediol diacetate |
| CAS Registry Number |
628-67-1 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
174.089208927 u |
| Formula |
C8H14O4 |
| InChI |
InChI=1S/C8H14O4/c1-7(9)11-5-3-4-6-12-8(2)10/h3-6H2,1-2H3 |
| InChIKey |
XUKSWKGOQKREON-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
174.196 g/mol |
| Nominal Mass |
174 u |
| Quality |
993 |
| Retention Index |
1176 |
| SMILES |
C(OCCCCOC(=O)C)(=O)C |
| SPLASH |
splash10-0006-9000000000-7e120e53ea9f4b94af45 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-(Acetyloxy)butyl acetate
1,4-Butylene glycol diacetate
Tetramethylene acetate
4-Acetyloxybutyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009115 |
