CID 11778

Guanidine, 1,1,3-triphenyl-

Structural Information

Molecular Formula
C19H17N3
SMILES
C1=CC=C(C=C1)N=C(N)N(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H17N3/c20-19(21-16-10-4-1-5-11-16)22(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H2,20,21)
InChIKey
RYCFRVNAZOREPC-UHFFFAOYSA-N
Compound name
1,1,2-triphenylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

2029
Patents

287.14224 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.14952 167.0
[M+Na]+ 310.13146 170.9
[M-H]- 286.13496 178.1
[M+NH4]+ 305.17606 181.5
[M+K]+ 326.10540 166.8
[M+H-H2O]+ 270.13950 156.8
[M+HCOO]- 332.14044 194.5
[M+CH3COO]- 346.15609 178.2
[M+Na-2H]- 308.11691 173.8
[M]+ 287.14169 163.7
[M]- 287.14279 163.7
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