CID 132472057

1,3-cyclohexanedimethanamine, n1,n3-bis(2-methylpropylidene)-

Structural Information

Molecular Formula
C16H30N2
SMILES
CC(C)C=NCC1CCCC(C1)CN=CC(C)C
InChI
InChI=1S/C16H30N2/c1-13(2)9-17-11-15-6-5-7-16(8-15)12-18-10-14(3)4/h9-10,13-16H,5-8,11-12H2,1-4H3
InChIKey
JUBKHAAUFRURMO-UHFFFAOYSA-N
Compound name
2-methyl-N-[[3-[(2-methylpropylideneamino)methyl]cyclohexyl]methyl]propan-1-imine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

250.2409 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.24818 166.7
[M+Na]+ 273.23012 168.2
[M-H]- 249.23362 171.1
[M+NH4]+ 268.27472 184.5
[M+K]+ 289.20406 166.8
[M+H-H2O]+ 233.23816 159.0
[M+HCOO]- 295.23910 187.9
[M+CH3COO]- 309.25475 208.4
[M+Na-2H]- 271.21557 166.4
[M]+ 250.24035 164.6
[M]- 250.24145 164.6
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.