| SpectraBase Spectrum ID |
KCI3vFGMReM |
| Name |
MONALID |
| CAS Registry Number |
7287-36-7 |
| 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 |
239.107691903 u |
| Formula |
C13H18ClNO |
| InChI |
InChI=1S/C13H18ClNO/c1-4-9-13(2,3)12(16)15-11-7-5-10(14)6-8-11/h5-8H,4,9H2,1-3H3,(H,15,16) |
| InChIKey |
KXGYBSNVFXBPNO-UHFFFAOYSA-N |
| Molecular Weight |
239.746 g/mol |
| Nominal Mass |
239 u |
| Number of Peaks |
76 |
| SMILES |
N(c1ccc(cc1)Cl)C(C(CCC)(C)C)=O |
| SPLASH |
splash10-000f-9200000000-74f8ea4e8bab73a43dd6 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
N-(4-chlorophenyl)-2,2-dimethylpentanamide |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4076 |
