| SpectraBase Spectrum ID |
5AUPsaHfk |
| Name |
3-Neopentyl Toluene |
| Appearance |
Colorless-transparent liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18 |
| InChI |
InChI=1S/C12H18/c1-10-6-5-7-11(8-10)9-12(2,3)4/h5-8H,9H2,1-4H3 |
| InChIKey |
ZFGLNABMBQZVKV-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP2010 Ultra |
| Ionization Type |
EI |
| Molecular Weight |
162.276 g/mol |
| SMILES |
C(Cc1cc(ccc1)C)(C)(C)C |
| SPLASH |
splash10-0a4i-8900000000-dd33e013648bc14131e9 |
| Source of Spectrum |
WO2021075517A1 |
| Wiley ID |
1880114 |
