Spectrum KO009152 for Pirimicarb

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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/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3
YFGYUFNIOHWBOB-UHFFFAOYSA-N
C11H18N4O2
238.142975816
O=C(OC=1N=C(N=C(C1C)C)N(C)C)N(C)C

Mass Spectral Metadata

NameValue
KO009152
2011.12.05 (Created 2008.05.12)
Ojima Y, Kakazu Y, Horai H, Soga T, Institute for Advanced Biosciences, Keio Univ.
CC BY-NC-SA
238.14298
LC/MSD Trap XCT, Agilent Technologies
LC-ESI-IT
MS3
0.70/0.80
LC/MSD Trap Control and Data Analysis
positive
239/195
[M+H]+
1.4597145988372286
0.47945601607349203
195.0
[M+H]+
226415.1067487179 ppm
-44.15094581599999 Da