CID 3042093

59083-46-4

Structural Information

Molecular Formula
C10H21N3
SMILES
CC1(CCCCC1)NC(=NC)NC
InChI
InChI=1S/C10H21N3/c1-10(7-5-4-6-8-10)13-9(11-2)12-3/h4-8H2,1-3H3,(H2,11,12,13)
InChIKey
XQDZREOVFHDSDB-UHFFFAOYSA-N
Compound name
1,2-dimethyl-3-(1-methylcyclohexyl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.17355 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.18083 143.5
[M+Na]+ 206.16277 146.4
[M-H]- 182.16627 147.4
[M+NH4]+ 201.20737 164.9
[M+K]+ 222.13671 145.9
[M+H-H2O]+ 166.17081 137.4
[M+HCOO]- 228.17175 167.1
[M+CH3COO]- 242.18740 190.3
[M+Na-2H]- 204.14822 149.3
[M]+ 183.17300 137.7
[M]- 183.17410 137.7
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

No patent data available for this compound.