CID 43558

Guanidine, dodecanedi-, dihydrochloride

Structural Information

Molecular Formula
C14H32N6
SMILES
C(CCCCCCN=C(N)N)CCCCCN=C(N)N
InChI
InChI=1S/C14H32N6/c15-13(16)19-11-9-7-5-3-1-2-4-6-8-10-12-20-14(17)18/h1-12H2,(H4,15,16,19)(H4,17,18,20)
InChIKey
ZIZFGSKWOGWBOO-UHFFFAOYSA-N
Compound name
2-[12-(diaminomethylideneamino)dodecyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

26
References

10
Patents

284.26886 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.27614 171.1
[M+Na]+ 307.25808 171.0
[M-H]- 283.26158 170.6
[M+NH4]+ 302.30268 185.0
[M+K]+ 323.23202 169.5
[M+H-H2O]+ 267.26612 161.8
[M+HCOO]- 329.26706 197.0
[M+CH3COO]- 343.28271 223.1
[M+Na-2H]- 305.24353 170.0
[M]+ 284.26831 167.3
[M]- 284.26941 167.3
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.