| SpectraBase Spectrum ID |
1RKgJMApR8a |
| Name |
Undecylbenzene |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.219100902 u |
| Formula |
C17H28 |
| InChI |
InChI=1S/C17H28/c1-2-3-4-5-6-7-8-9-11-14-17-15-12-10-13-16-17/h10,12-13,15-16H,2-9,11,14H2,1H3 |
| InChIKey |
XBEADGFTLHRJRB-UHFFFAOYSA-N |
| Instrument Name |
Agilent 7890B-5977A GC |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201712731 |
| Molecular Weight |
232.411 g/mol |
| Quality |
369 |
| Reported Formula |
C17H28 |
| SMILES |
C(CCCC1=CC=CC=C1)CCCCCCC |
| SPLASH |
splash10-0006-9220000000-ed848032688a639302df |
| Sample Comments |
Regioisomeric ratio = 82:1 |
| Source of Spectrum |
ACI-57-SM40-3a (DOI: 10.1002/anie.201712731) |
| Wiley ID |
1890621 |
