CID 58363

101418-49-9

Structural Information

Molecular Formula
C26H48N2
SMILES
C1CCC(CC1)N(CCN(C2CCCCC2)C3CCCCC3)C4CCCCC4
InChI
InChI=1S/C26H48N2/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h23-26H,1-22H2
InChIKey
LJVHUNUMQUEARE-UHFFFAOYSA-N
Compound name
N,N,N',N'-tetracyclohexylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

388.38174 Da
Monoisotopic Mass

7.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.38902 199.6
[M+Na]+ 411.37096 189.4
[M-H]- 387.37446 207.9
[M+NH4]+ 406.41556 208.4
[M+K]+ 427.34490 186.5
[M+H-H2O]+ 371.37900 187.0
[M+HCOO]- 433.37994 207.8
[M+CH3COO]- 447.39559 230.4
[M+Na-2H]- 409.35641 193.1
[M]+ 388.38119 181.0
[M]- 388.38229 181.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe