CID 9575513

1-[(e)-(3-methoxy-4-phenoxy-phenyl)methyleneamino]guanidine

Structural Information

Molecular Formula
C15H16N4O2
SMILES
COC1=C(C=CC(=C1)/C=N/N=C(N)N)OC2=CC=CC=C2
InChI
InChI=1S/C15H16N4O2/c1-20-14-9-11(10-18-19-15(16)17)7-8-13(14)21-12-5-3-2-4-6-12/h2-10H,1H3,(H4,16,17,19)/b18-10+
InChIKey
VPAWUFKEJMLCSF-VCHYOVAHSA-N
Compound name
2-[(E)-(3-methoxy-4-phenoxyphenyl)methylideneamino]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

284.12732 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13460 164.0
[M+Na]+ 307.11654 169.7
[M-H]- 283.12004 172.5
[M+NH4]+ 302.16114 179.1
[M+K]+ 323.09048 167.2
[M+H-H2O]+ 267.12458 154.5
[M+HCOO]- 329.12552 193.6
[M+CH3COO]- 343.14117 213.5
[M+Na-2H]- 305.10199 169.4
[M]+ 284.12677 163.7
[M]- 284.12787 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

No patent data available for this compound.