| SpectraBase Spectrum ID |
JICB8UWaOfb |
| Name |
Nitrobenzol |
| CAS Registry Number |
98-95-3 |
| 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 |
123.032028403 u |
| Formula |
C6H5NO2 |
| InChI |
InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H |
| InChIKey |
LQNUZADURLCDLV-UHFFFAOYSA-N |
| Molecular Weight |
123.111 g/mol |
| Number of Peaks |
49 |
| RI1 |
1087 |
| RI2 |
761 |
| SMILES |
c1c(cccc1)N(=O)=O |
| SPLASH |
splash10-0fi0-9200000000-cc68b341a9b6d8453a84 |
| 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, nitro- |
| Wiley ID |
LM_FFNSC3_1433 |
