CID 3022720

Einecs 299-342-3

Structural Information

Molecular Formula
C19H36N2
SMILES
CC1CCC(CC1N=C(C)CC(C)C)N=C(C)CC(C)C
InChI
InChI=1S/C19H36N2/c1-13(2)10-16(6)20-18-9-8-15(5)19(12-18)21-17(7)11-14(3)4/h13-15,18-19H,8-12H2,1-7H3
InChIKey
XXHWBPRCTBQGPX-UHFFFAOYSA-N
Compound name
4-methyl-N-[4-methyl-3-(4-methylpentan-2-ylideneamino)cyclohexyl]pentan-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.28784 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.295116 179.7
[M+Na]+ 315.277058 180.6
[M-H]- 291.280564 184.1
[M+NH4]+ 310.321663 196.1
[M+K]+ 331.250998 179.4
[M+H-H2O]+ 275.285100 172.2
[M+HCOO]- 337.286041 197.9
[M+CH3COO]- 351.301691 220.4
[M+Na-2H]- 313.262506 174.8
[M]+ 292.28729142 177.9
[M]- 292.28838858 177.9
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.