| SpectraBase Spectrum ID |
8FMBrxP4vx2 |
| Name |
Pentaerythritoltetranitrate |
| CAS Registry Number |
78-11-5 |
| Classification |
Explosive |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
316.013871702 u |
| Formula |
C5H8N4O12 |
| InChI |
InChI=1S/C5H8N4O12/c10-6(11)18-1-5(2-19-7(12)13,3-20-8(14)15)4-21-9(16)17/h1-4H2 |
| InChIKey |
TZRXHJWUDPFEEY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
316.135 g/mol |
| Nominal Mass |
316 u |
| Quality |
725 |
| Retention Index |
2428 |
| SMILES |
C(CO[N+](=O)[O-])(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-] |
| SPLASH |
splash10-0002-9000000000-d69631d0790a4d2f0ab5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Nitropenta
PETN
2,2-Bis(hydroxymethyl)-1,3-propanedioltetranitrate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013775 |
