| SpectraBase Spectrum ID |
2mIHtSrzccC |
| Name |
alpha-Methyl-4-(2-methylpropyl)benzeneacetaldehyde |
| CAS Registry Number |
51407-46-6 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-4-10(2)12-5-7-13(8-6-12)11(3)9-14/h5-11H,4H2,1-3H3 |
| InChIKey |
VRHXWBGZHRZILD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
190.286 g/mol |
| Nominal Mass |
190 u |
| Quality |
859 |
| Retention Index |
1420 |
| SMILES |
C1(C(C=O)C)=CC=C(C(CC)C)C=C1 |
| SPLASH |
splash10-03di-2900000000-7b2f9afdbd45fe0f673d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-(4-(butan-2-yl)phenyl)propanal |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002304 |
