CID 31645

Pirimicarb

Structural Information

Molecular Formula
C11H18N4O2
SMILES
CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C
InChI
InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3
InChIKey
YFGYUFNIOHWBOB-UHFFFAOYSA-N
Compound name
[2-(dimethylamino)-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

214
References

32289
Patents

238.14297 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15025 154.7
[M+Na]+ 261.13219 162.9
[M-H]- 237.13569 159.3
[M+NH4]+ 256.17679 171.2
[M+K]+ 277.10613 163.8
[M+H-H2O]+ 221.14023 146.4
[M+HCOO]- 283.14117 178.8
[M+CH3COO]- 297.15682 205.8
[M+Na-2H]- 259.11764 158.0
[M]+ 238.14242 160.0
[M]- 238.14352 160.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe