| SpectraBase Spectrum ID |
10BeZIoTMxf |
| Name |
Dodecanenitrile |
| CAS Registry Number |
2437-25-4 |
| 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 |
181.183049745 u |
| Formula |
C12H23N |
| InChI |
InChI=1S/C12H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-11H2,1H3 |
| InChIKey |
VXCUURYYWGCLIH-UHFFFAOYSA-N |
| Molecular Weight |
181.323 g/mol |
| Number of Peaks |
50 |
| RI1 |
1487 |
| RI2 |
1165 |
| RI3 |
1338 |
| RI4 |
1298 |
| SMILES |
C(CCCCCCCCCCC)#N |
| SPLASH |
splash10-0537-9200000000-2e8a50ef71cac28293d4 |
| 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 |
Dodecanenitrile |
| Wiley ID |
LM_FFNSC3_1270 |
