CID 12254240

2-(benzyloxy)benzene-1-carboximidamide hydrochloride

Structural Information

Molecular Formula
C14H14N2O
SMILES
C1=CC=C(C=C1)COC2=CC=CC=C2C(=N)N
InChI
InChI=1S/C14H14N2O/c15-14(16)12-8-4-5-9-13(12)17-10-11-6-2-1-3-7-11/h1-9H,10H2,(H3,15,16)
InChIKey
YPRKIADCXYBSLE-UHFFFAOYSA-N
Compound name
2-phenylmethoxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

226.11061 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.11789 150.2
[M+Na]+ 249.09983 156.0
[M-H]- 225.10333 156.4
[M+NH4]+ 244.14443 167.1
[M+K]+ 265.07377 152.1
[M+H-H2O]+ 209.10787 142.4
[M+HCOO]- 271.10881 175.5
[M+CH3COO]- 285.12446 194.4
[M+Na-2H]- 247.08528 156.1
[M]+ 226.11006 147.4
[M]- 226.11116 147.4
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