CID 24845566

94982-14-6

Structural Information

Molecular Formula
C10H23N4
SMILES
C[N+]1(CCCC1)CCCCN=C(N)N
InChI
InChI=1S/C10H23N4/c1-14(8-4-5-9-14)7-3-2-6-13-10(11)12/h2-9H2,1H3,(H4,11,12,13)/q+1
InChIKey
NKYLCNPLCADRKP-UHFFFAOYSA-N
Compound name
2-[4-(1-methylpyrrolidin-1-ium-1-yl)butyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.19228 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.199556 143.0
[M+Na]+ 222.181498 146.4
[M-H]- 198.185004 144.9
[M+NH4]+ 217.226103 163.5
[M+K]+ 238.155438 139.5
[M+H-H2O]+ 182.189540 138.8
[M+HCOO]- 244.190481 165.8
[M+CH3COO]- 258.206131 185.6
[M+Na-2H]- 220.166946 148.7
[M]+ 199.19173142 136.3
[M]- 199.19282858 136.3
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.