| SpectraBase Spectrum ID |
54HQobXN9Ak |
| Name |
Isoaminile |
| CAS Registry Number |
77-51-0 |
| Collision Energy |
40 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
244.193948781 u |
| Formula |
C16H24N2 |
| InChI |
InChI=1S/C16H24N2/c1-13(2)16(12-17,11-14(3)18(4)5)15-9-7-6-8-10-15/h6-10,13-14H,11H2,1-5H3 |
| InChIKey |
WFLSCFISQHLEED-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
244.382 g/mol |
| Nominal Mass |
244 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
245.201 |
| SMILES |
C(N(C)C)(CC(C(C)C)(C1=CC=CC=C1)C#N)C |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
4-(dimethylamino)-2-phenyl-2-propan-2-ylpentanenitrile |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_440.7 |
