CID 3046492

Perimidine, 2-amino-1-phenyl-

Structural Information

Molecular Formula
C17H13N3
SMILES
C1=CC=C(C=C1)N2C3=CC=CC4=C3C(=CC=C4)N=C2N
InChI
InChI=1S/C17H13N3/c18-17-19-14-10-4-6-12-7-5-11-15(16(12)14)20(17)13-8-2-1-3-9-13/h1-11H,(H2,18,19)
InChIKey
QSLSYDPWKUYYGD-UHFFFAOYSA-N
Compound name
1-phenylperimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.11096 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.11824 159.4
[M+Na]+ 282.10018 168.4
[M-H]- 258.10368 164.1
[M+NH4]+ 277.14478 175.0
[M+K]+ 298.07412 161.6
[M+H-H2O]+ 242.10822 149.4
[M+HCOO]- 304.10916 178.5
[M+CH3COO]- 318.12481 170.6
[M+Na-2H]- 280.08563 168.9
[M]+ 259.11041 157.8
[M]- 259.11151 157.8
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.