CID 24845570

93483-84-2

Structural Information

Molecular Formula
C9H21N4
SMILES
C[N+]1(CCCC1)CCCN=C(N)N
InChI
InChI=1S/C9H21N4/c1-13(6-2-3-7-13)8-4-5-12-9(10)11/h2-8H2,1H3,(H4,10,11,12)/q+1
InChIKey
SVYYPUHOVROWDZ-UHFFFAOYSA-N
Compound name
2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.17662 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.18390 138.5
[M+Na]+ 208.16584 142.4
[M-H]- 184.16934 140.6
[M+NH4]+ 203.21044 159.6
[M+K]+ 224.13978 135.8
[M+H-H2O]+ 168.17388 134.6
[M+HCOO]- 230.17482 161.7
[M+CH3COO]- 244.19047 182.6
[M+Na-2H]- 206.15129 144.7
[M]+ 185.17607 131.5
[M]- 185.17717 131.5
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

No patent data available for this compound.