CID 86367

Cyprodinil

Structural Information

Molecular Formula
C14H15N3
SMILES
CC1=CC(=NC(=N1)NC2=CC=CC=C2)C3CC3
InChI
InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)
InChIKey
HAORKNGNJCEJBX-UHFFFAOYSA-N
Compound name
4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

104
References

54616
Patents

225.1266 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.13388 153.7
[M+Na]+ 248.11582 163.3
[M-H]- 224.11932 161.4
[M+NH4]+ 243.16042 164.2
[M+K]+ 264.08976 157.9
[M+H-H2O]+ 208.12386 144.3
[M+HCOO]- 270.12480 177.3
[M+CH3COO]- 284.14045 165.5
[M+Na-2H]- 246.10127 160.9
[M]+ 225.12605 154.7
[M]- 225.12715 154.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.