CID 3056595

1-(2-((n-(2-methyldiphenylmethoxy)ethyl)-n-methylamino)ethyl)guanidine dihydrogenfumarate

Structural Information

Molecular Formula
C20H28N4O
SMILES
CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)CCN=C(N)N
InChI
InChI=1S/C20H28N4O/c1-16-8-6-7-11-18(16)19(17-9-4-3-5-10-17)25-15-14-24(2)13-12-23-20(21)22/h3-11,19H,12-15H2,1-2H3,(H4,21,22,23)
InChIKey
PRQRXZGPXQTOOA-UHFFFAOYSA-N
Compound name
2-[2-[methyl-[2-[(2-methylphenyl)-phenylmethoxy]ethyl]amino]ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.22632 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.23360 187.0
[M+Na]+ 363.21554 195.8
[M+NH4]+ 358.26014 193.6
[M+K]+ 379.18948 189.1
[M-H]- 339.21904 193.1
[M+Na-2H]- 361.20099 194.0
[M]+ 340.22577 189.6
[M]- 340.22687 189.6
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

No patent data available for this compound.