Spectrum WA000092 for Thiamethoxam

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8-
NWWZPOKUUAIXIW-FLIBITNWSA-N
C8H10ClN5O3S
291.01928785999996
O=N(=O)N=C1N(C)COCN1CC=2SC(Cl)=NC2

Mass Spectral Metadata

NameValue
WA000092
2016.01.19 (Created 2007.08.01, modified 2011.05.06)
Nihon Waters K.K.
CC BY-NC
291.01929
QuattroPremier XE, Waters
LC-ESI-QQ
MS2
30 V
ignore rel.int. < 5
positive
2.0335183636109035
0.6317479996899749
292.06
[M+H]+
112.10758063424962 ppm
0.032742140000038944 Da