CID 3022827

93893-86-8

Structural Information

Molecular Formula
C7H15N3O2
SMILES
C=CCOCC(CN=C(N)N)O
InChI
InChI=1S/C7H15N3O2/c1-2-3-12-5-6(11)4-10-7(8)9/h2,6,11H,1,3-5H2,(H4,8,9,10)
InChIKey
GAUBBDJSGNOAHW-UHFFFAOYSA-N
Compound name
2-(2-hydroxy-3-prop-2-enoxypropyl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

173.11642 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.123696 139.6
[M+Na]+ 196.105638 143.9
[M-H]- 172.109144 138.6
[M+NH4]+ 191.150243 158.2
[M+K]+ 212.079578 143.3
[M+H-H2O]+ 156.113680 133.3
[M+HCOO]- 218.114621 163.7
[M+CH3COO]- 232.130271 187.1
[M+Na-2H]- 194.091086 142.0
[M]+ 173.11587142 136.7
[M]- 173.11696858 136.7
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