| SpectraBase Spectrum ID |
JJICD5aKszY |
| Name |
Acetonperoxide |
| CAS Registry Number |
17088-37-8 |
| Classification |
Explosive |
| 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 |
222.110338294 u |
| Formula |
C9H18O6 |
| InChI |
InChI=1S/C9H18O6/c1-7(2)10-12-8(3,4)14-15-9(5,6)13-11-7/h1-6H3 |
| InChIKey |
ZTLXICJMNFREPA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.237 g/mol |
| Nominal Mass |
222 u |
| Quality |
533 |
| Retention Index |
1095 |
| SMILES |
C1(OOC(OOC(OO1)(C)C)(C)C)(C)C |
| SPLASH |
splash10-0006-9000000000-3a62ade31c84bf0c9320 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Peroxyacetone
TATP
TCAP
Triacetone triperoxide
3,3,6,6,9,9-Hexamethyl-1,2,4,5,7,8-hexanoxacyclononane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013674 |
