SpectraBase Spectrum ID |
D2TWT8zi4ro |
Name |
-(2-Iodophenyl)-2-(trans-octahydroquinolin-1(2H)-yl)ethane-1,2-dione |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H20INO2 |
InChI |
InChI=1S/C17H20INO2/c18-14-9-3-2-8-13(14)16(20)17(21)19-11-5-7-12-6-1-4-10-15(12)19/h2-3,8-9,12,15H,1,4-7,10-11H2/t12-,15+/m1/s1 |
InChIKey |
DQOFDBMVPSSEDM-DOMZBBRYSA-N |
Instrument Name |
FINNIGAN MAT 95Q |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.202205440 |
Molecular Weight |
397.256 g/mol |
Quality |
141 |
Reported Formula |
C17H20INO2 |
SMILES |
C1=CC=C(C(=C1)I)C(C(=O)N1CCC[C@@]2([C@@]1(CCCC2)[H])[H])=O |
SPLASH |
splash10-014i-5910000000-c2d5f4a0854352477f94 |
Source of Spectrum |
ACI-61-SM37-11d (DOI: 10.1002/anie.202205440) |
Wiley ID |
1897853 |