CID 49607

Brn 2529860

Structural Information

Molecular Formula
C10H15N3O2
SMILES
COC1=CC=C(C=C1)OCCN=C(N)N
InChI
InChI=1S/C10H15N3O2/c1-14-8-2-4-9(5-3-8)15-7-6-13-10(11)12/h2-5H,6-7H2,1H3,(H4,11,12,13)
InChIKey
JLNFXSAGSVOXOX-UHFFFAOYSA-N
Compound name
2-[2-(4-methoxyphenoxy)ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

209.11642 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.123696 145.5
[M+Na]+ 232.105638 151.2
[M-H]- 208.109144 149.5
[M+NH4]+ 227.150243 163.5
[M+K]+ 248.079578 150.1
[M+H-H2O]+ 192.113680 138.0
[M+HCOO]- 254.114621 172.7
[M+CH3COO]- 268.130271 195.2
[M+Na-2H]- 230.091086 150.5
[M]+ 209.11587142 145.1
[M]- 209.11696858 145.1
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