SpectraBase Spectrum ID |
BwKcE4YLexD |
Name |
5-benzyloxy-6-methoxy-7-methyl-2-methylene-3a,4-dihydro-3H-pyrrolo[1,2-a]indol-1-one |
Appearance |
White solid |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
335.152143537 u |
Formula |
C21H21NO3 |
InChI |
InChI=1S/C21H21NO3/c1-13-10-18-17(11-16-9-14(2)21(23)22(16)18)20(19(13)24-3)25-12-15-7-5-4-6-8-15/h4-8,10,16H,2,9,11-12H2,1,3H3 |
InChIKey |
VGOCGVPRJNYFNR-UHFFFAOYSA-N |
Instrument Name |
Thermo Scientific Orbitrap Fusion system |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201701895 |
Molecular Weight |
335.403 g/mol |
Quality |
82 |
Reported Formula |
C21H21O3N |
SMILES |
C1(=C(C2=C(C=C1C)N1C(C2)CC(C1=O)=C)OCC1=CC=CC=C1)OC |
SPLASH |
splash10-00ko-5096000000-08e5bacf052f16c32fa5 |
Source of Spectrum |
ACI-56-SM39-(+ or -)-3e (DOI: 10.1002/anie.201701895) |
Thin-Layer Chromatography |
0.18 (EtOAc/n-hexane, 1:4) |
Wiley ID |
1895863 |