| SpectraBase Spectrum ID |
GXN8GV4HI7k |
| Name |
Pentane |
| CAS Registry Number |
109-66-0 |
| Classification |
Solvent |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
72.093900386 u |
| Formula |
C5H12 |
| InChI |
InChI=1S/C5H12/c1-3-5-4-2/h3-5H2,1-2H3 |
| InChIKey |
OFBQJSOFQDEBGM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
72.151 g/mol |
| Nominal Mass |
72 u |
| Quality |
993 |
| Retention Index |
500 |
| SMILES |
C(CC)CC |
| SPLASH |
splash10-0006-9000000000-9ede727e04395a33a083 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
pentane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_008287 |
