CID 206676

Acetamidine, n-benzyl-2-phenyl-, hydrochloride

Structural Information

Molecular Formula
C15H16N2
SMILES
C1=CC=C(C=C1)CC(=NCC2=CC=CC=C2)N
InChI
InChI=1S/C15H16N2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,16,17)
InChIKey
XRPNFHZMXJLYKS-UHFFFAOYSA-N
Compound name
N'-benzyl-2-phenylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

224.13135 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13863 151.5
[M+Na]+ 247.12057 156.5
[M-H]- 223.12407 158.5
[M+NH4]+ 242.16517 169.0
[M+K]+ 263.09451 152.6
[M+H-H2O]+ 207.12861 143.3
[M+HCOO]- 269.12955 177.7
[M+CH3COO]- 283.14520 196.1
[M+Na-2H]- 245.10602 158.1
[M]+ 224.13080 149.0
[M]- 224.13190 149.0
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