SpectraBase Spectrum ID |
GgTyuz8pjbc |
Name |
Triclosan |
CAS Registry Number |
3380-34-5 |
Classification |
Antiseptic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
287.951162563 u |
Formula |
C12H7Cl3O2 |
InChI |
InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H |
InChIKey |
XEFQLINVKFYRCS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
289.545 g/mol |
SMILES |
c1(ccc(Oc2c(cc(cc2)Cl)Cl)c(c1)O)Cl |
SPLASH |
splash10-03y4-7890000000-cb5f87193dc6ca92be25 |
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. |
Sample Preparation Procedure |
Detected: U |
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_691 |