| SpectraBase Spectrum ID |
6qSNsOTu1RQ |
| Name |
Propyl 3,5-dimethyl-1-phenyl-1H-pyrazole-4-sulfonate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.103813619 u |
| Formula |
C14H18N2O3S |
| InChI |
InChI=1S/C14H18N2O3S/c1-4-10-19-20(17,18)14-11(2)15-16(12(14)3)13-8-6-5-7-9-13/h5-9H,4,10H2,1-3H3 |
| InChIKey |
PTHBHMUVFMMBDY-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5975N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201612565 |
| Quality |
32 |
| Reported Formula |
C14H18N2O3S |
| SMILES |
C=1(S(OCCC)(=O)=O)C(=NN(C1C)C1=CC=CC=C1)C |
| SPLASH |
splash10-0udl-0390000000-b9c2378c8f44d34919fb |
| Source of Spectrum |
ACI-56-SM39-6b (DOI: 10.1002/anie.201612565) |
| Wiley ID |
1895568 |
