SpectraBase Spectrum ID |
BFDMHc7P9WV |
Name |
3-(4-chlorophenyl)-2,2-dimethyl-propanoic acid |
Carrier Gas |
Helium (1 ml/min) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
212.060407357 u |
Formula |
C11H13ClO2 |
GC Column |
Restek Rtx-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer) |
GC Oven Program |
Oven temp 220oC |
InChI |
InChI=1S/C11H13ClO2/c1-11(2,10(13)14)7-8-3-5-9(12)6-4-8/h3-6H,7H2,1-2H3,(H,13,14) |
InChIKey |
BTCKPHZRFQRLHP-UHFFFAOYSA-N |
Inlet Type |
Split |
Instrument Name |
Thermo Scientific DSQII single quadrupole |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202200313 |
Molecular Weight |
212.676 g/mol |
Quality |
138 |
SMILES |
OC(C(CC1=CC=C(C=C1)Cl)(C)C)=O |
SPLASH |
splash10-004i-1910000000-1415b7f947e8a40bd3d9 |
Source of Spectrum |
QE-28-SM5-1b (DOI: 10.1002/chem.202200313) |
Wiley ID |
1900405 |