| SpectraBase Spectrum ID |
3vyROfPD1GQ |
| Name |
Hexachlorophene |
| CAS Registry Number |
70-30-4 |
| Classification |
Pesticide |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
403.849895631 u |
| Formula |
C13H6Cl6O2 |
| InChI |
InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2 |
| InChIKey |
ACGUYXCXAPNIKK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
406.907 g/mol |
| SMILES |
c1(c(c(Cc2c(c(cc(c2O)Cl)Cl)Cl)c(c(c1)Cl)Cl)O)Cl |
| SPLASH |
splash10-0a4j-0894700000-b060f3f705909036fa36 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3644 |
