| SpectraBase Spectrum ID |
9jcjrok4UcC |
| Name |
(E)-7-(1-Tosyl-1H-pyrrol-2-yl)hept-3-en-2-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.124214711 u |
| Formula |
C18H21NO3S |
| InChI |
InChI=1S/C18H21NO3S/c1-15-10-12-18(13-11-15)23(21,22)19-14-6-9-17(19)8-5-3-4-7-16(2)20/h4,6-7,9-14H,3,5,8H2,1-2H3/b7-4+ |
| InChIKey |
QUIKXDYFYSRJMV-QPJJXVBHSA-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 |
331.430 g/mol |
| Quality |
32 |
| Reported Formula |
C18H21NO3S |
| SMILES |
C=1(N(C=CC1)S(C1=CC=C(C=C1)C)(=O)=O)CCC\C=C\C(C)=O |
| SPLASH |
splash10-0a4i-0940000000-3a8fb6ca711fe650c26c |
| Source of Spectrum |
ACI-57-SM14-2c.2 (DOI: 10.1002/anie.201711439) |
| Thin-Layer Chromatography |
0.27 (EtOAc/hexane, 20%) |
| Wiley ID |
1890668 |
