| SpectraBase Spectrum ID |
KrQmZAOrpQe |
| Name |
Benzenepropanenitrile <4-ethyl-, alpha,alpha-, dimethyl-> |
| CAS Registry Number |
134123-93-6 |
| 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 |
187.136099551 u |
| Formula |
C13H17N |
| InChI |
InChI=1S/C13H17N/c1-4-11-5-7-12(8-6-11)9-13(2,3)10-14/h5-8H,4,9H2,1-3H3 |
| InChIKey |
NWMCCMGWYCKNJR-UHFFFAOYSA-N |
| Molecular Weight |
187.286 g/mol |
| Number of Peaks |
50 |
| RI1 |
1477 |
| RI2 |
1155 |
| RI3 |
1472 |
| RI4 |
1433 |
| SMILES |
c1c(ccc(c1)CC(C#N)(C)C)CC |
| SPLASH |
splash10-014i-3900000000-6372e02ba94e7016fa45 |
| 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 |
Benzenepropanenitrile, 4-ethyl- alpha, alpha-dimethyl- |
| Wiley ID |
LM_FFNSC3_1293 |
