| SpectraBase Spectrum ID |
JGsF8UugcIS |
| Name |
1H-Isoindol-1-one,2,3-dihydro-6,7-dimethyl-3-(2-methylpropyl) |
| CAS Registry Number |
71940-27-7 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
217.146664235 u |
| Formula |
C14H19NO |
| InChI |
InChI=1S/C14H19NO/c1-8(2)7-12-11-6-5-9(3)10(4)13(11)14(16)15-12/h5-6,8,12H,7H2,1-4H3,(H,15,16) |
| InChIKey |
HITFRWYSLAVOAX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
217.312 g/mol |
| Nominal Mass |
217 u |
| Quality |
992 |
| Retention Index |
1676 |
| SMILES |
C=12C(C(NC2=O)CC(C)C)=CC=C(C1C)C |
| SPLASH |
splash10-03di-1910000000-6e6d2f799466de4d03de |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6,7-dimethyl-3-(2-methylpropyl)-2,3-dihydro-1H-isoindol-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032534 |
