SpectraBase Spectrum ID |
56gxzFydaQU |
Name |
1-[5-(2,2,2-trichloro-1-oxoethyl)-1H-pyrrol-2-yl]-1-butanone |
Alternate Name(s) |
1-[5-(2,2,2-trichloroacetyl)-1H-pyrrol-2-yl]butan-1-one
1-[5-[2,2,2-tris(chloranyl)ethanoyl]-1H-pyrrol-2-yl]butan-1-one |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H10Cl3NO2 |
InChI |
InChI=1S/C10H10Cl3NO2/c1-2-3-8(15)6-4-5-7(14-6)9(16)10(11,12)13/h4-5,14H,2-3H2,1H3 |
InChIKey |
ROKZFJTZUBSYHP-UHFFFAOYSA-N |
Molecular Weight |
282.554 g/mol |
SMILES |
[nH]1c(ccc1C(C(Cl)(Cl)Cl)=O)C(=O)CCC |
SPLASH |
splash10-03di-0900000000-ddfc2f526cbe6962494e |
Source of Spectrum |
E1-44-53-19 |
Wiley ID |
1553239 |