CID 9460

Guanidine, 1-benzyl-1-phenyl-, hydrochloride

Structural Information

Molecular Formula
C14H15N3
SMILES
C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=N)N
InChI
InChI=1S/C14H15N3/c15-14(16)17(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2,(H3,15,16)
InChIKey
NEVBMUVMOAABDA-UHFFFAOYSA-N
Compound name
1-benzyl-1-phenylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

225.1266 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.13388 150.9
[M+Na]+ 248.11582 155.1
[M-H]- 224.11932 158.0
[M+NH4]+ 243.16042 167.8
[M+K]+ 264.08976 152.1
[M+H-H2O]+ 208.12386 142.5
[M+HCOO]- 270.12480 177.4
[M+CH3COO]- 284.14045 199.0
[M+Na-2H]- 246.10127 157.1
[M]+ 225.12605 146.7
[M]- 225.12715 146.7
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

patents stripe