CID 3047480

Perimidine, 2-(p-aminophenyl)-1-methyl-

Structural Information

Molecular Formula
C18H15N3
SMILES
CN1C2=CC=CC3=C2C(=CC=C3)N=C1C4=CC=C(C=C4)N
InChI
InChI=1S/C18H15N3/c1-21-16-7-3-5-12-4-2-6-15(17(12)16)20-18(21)13-8-10-14(19)11-9-13/h2-11H,19H2,1H3
InChIKey
UQKKKFYLSREVGH-UHFFFAOYSA-N
Compound name
4-(1-methylperimidin-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.1266 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.13388 165.2
[M+Na]+ 296.11582 174.6
[M-H]- 272.11932 170.1
[M+NH4]+ 291.16042 180.5
[M+K]+ 312.08976 167.7
[M+H-H2O]+ 256.12386 155.2
[M+HCOO]- 318.12480 183.9
[M+CH3COO]- 332.14045 176.3
[M+Na-2H]- 294.10127 173.3
[M]+ 273.12605 164.3
[M]- 273.12715 164.3
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.