CID 26508

14156-77-5

Structural Information

Molecular Formula
C11H18N4
SMILES
CN(CCN=C(N)N)CC1=CC=CC=C1
InChI
InChI=1S/C11H18N4/c1-15(8-7-14-11(12)13)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H4,12,13,14)
InChIKey
SDERWXCAJHTXAR-UHFFFAOYSA-N
Compound name
2-[2-[benzyl(methyl)amino]ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

206.15315 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.160426 148.2
[M+Na]+ 229.142368 152.0
[M-H]- 205.145874 153.1
[M+NH4]+ 224.186973 166.4
[M+K]+ 245.116308 151.1
[M+H-H2O]+ 189.150410 140.1
[M+HCOO]- 251.151351 176.0
[M+CH3COO]- 265.167001 201.4
[M+Na-2H]- 227.127816 152.9
[M]+ 206.15260142 145.5
[M]- 206.15369858 145.5
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