| SpectraBase Spectrum ID |
2lOf8JPRCb2 |
| Name |
Pentylbenzene |
| CAS Registry Number |
538-68-1 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (four 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 |
148.125200515 u |
| Formula |
C11H16 |
| InChI |
InChI=1S/C11H16/c1-2-3-5-8-11-9-6-4-7-10-11/h4,6-7,9-10H,2-3,5,8H2,1H3 |
| InChIKey |
PWATWSYOIIXYMA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
148.249 g/mol |
| Nominal Mass |
148 u |
| Quality |
907 |
| Retention Index |
1085 |
| SMILES |
C1(=CC=CC=C1)CCCCC |
| SPLASH |
splash10-0006-9200000000-8cdcef438405565b1815 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Amylbenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018265 |
