| SpectraBase Spectrum ID |
JtIxQ5FsBD0 |
| Name |
1-((4-Nitrophenyl)sulfonyl)-2-(pent-4-en-1-yl)-1H-pyrrole |
| Appearance |
Yellow syrup |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.083078173 u |
| Formula |
C15H16N2O4S |
| InChI |
InChI=1S/C15H16N2O4S/c1-2-3-4-6-13-7-5-12-16(13)22(20,21)15-10-8-14(9-11-15)17(18)19/h2,5,7-12H,1,3-4,6H2 |
| InChIKey |
VRGNDMSWGGAOIR-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 or API QSTAR PULSAR iLC/MS/TOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201711439 |
| Molecular Weight |
320.363 g/mol |
| Quality |
84 |
| Reported Formula |
C15H16N2O4S |
| SMILES |
C=1(N(S(C2=CC=C(C=C2)[N+]([O-])=O)(=O)=O)C=CC1)CCCC=C |
| SPLASH |
splash10-00yr-0960000000-075537ab44dd1ac38549 |
| Source of Spectrum |
ACI-57-SM9-2e.1 (DOI: 10.1002/anie.201711439) |
| Thin-Layer Chromatography |
0.38 (acetone/hexane, 15%) |
| Wiley ID |
1890675 |
