| SpectraBase Spectrum ID |
84S6npSmJyb |
| Name |
3-Iodo-1-phenylsulfonyl-1H-pyrrolo[2,3-b]pyridin-5-yl pivalate |
| Appearance |
Colorless foam |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
483.995373205 u |
| Formula |
C18H17IN2O4S |
| InChI |
InChI=1S/C18H17IN2O4S/c1-18(2,3)17(22)25-12-9-14-15(19)11-21(16(14)20-10-12)26(23,24)13-7-5-4-6-8-13/h4-11H,1-3H3 |
| InChIKey |
XDBQQSNJVMILSV-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201602519 |
| Molecular Weight |
484.308 g/mol |
| Quality |
210 |
| Reported Formula |
C18H17N2O4SI |
| SMILES |
C=1(OC(=O)C(C)(C)C)C=NC2=C(C1)C(=CN2S(C1=CC=CC=C1)(=O)=O)I |
| SPLASH |
splash10-0pc9-5023900000-d441094437add0191415 |
| Source of Spectrum |
QE-22-SM24-23 (DOI: 10.1002/chem.201602519) |
| Wiley ID |
1907767 |
![3-Iodo-1-phenylsulfonyl-1H-pyrrolo[2,3-b]pyridin-5-yl pivalate](/api/spectrum/84S6npSmJyb/structure.png?h=300&w=458 "3-Iodo-1-phenylsulfonyl-1H-pyrrolo[2,3-b]pyridin-5-yl pivalate")
