| SpectraBase Spectrum ID |
AiaM3A72sl6 |
| Name |
2-Acetyl-1,2,3,4-tetrahydro-1-(3',3',3'-trichloro-2'-oxopropyl)-.beta.-carboline |
| Alternate Name(s) |
3-(2-acetyl-2,3,4,9-tetrahydro-1H-.beta.-carbolin-1-yl)-1,1,1-trichloroacetone |
| CAS Registry Number |
142656-11-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15Cl3N2O2 |
| InChI |
InChI=1S/C16H15Cl3N2O2/c1-9(22)21-7-6-11-10-4-2-3-5-12(10)20-15(11)13(21)8-14(23)16(17,18)19/h2-5,13,20H,6-8H2,1H3 |
| InChIKey |
HBJFMEPCJZLWBQ-UHFFFAOYSA-N |
| Molecular Weight |
373.667 g/mol |
| SMILES |
[nH]1c2ccccc2c2CCN(C(c12)CC(C(Cl)(Cl)Cl)=O)C(=O)C |
| SPLASH |
splash10-022d-3893000000-5c1457c2b40b3727d477 |
| Source of Spectrum |
U-1992-1066-7 |
| Wiley ID |
764517 |
