SpectraBase Spectrum ID |
ERdnaNZNwWz |
Name |
Benzene |
CAS Registry Number |
100-41-4 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
106.078250322 u |
Formula |
C8H10 |
InChI |
InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3 |
InChIKey |
YNQLUTRBYVCPMQ-UHFFFAOYSA-N |
Molecular Weight |
106.168 g/mol |
Number of Peaks |
48 |
RI1 |
857 |
RI2 |
518 |
SMILES |
c1cccc(c1)CC |
SPLASH |
splash10-0006-9200000000-743d695925427df604fd |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
Benzene, ethyl- |
Wiley ID |
LM_FFNSC3_1509 |