CID 75673

6-undecyl-1,3,5-triazine-2,4-diamine

Structural Information

Molecular Formula
C14H27N5
SMILES
CCCCCCCCCCCC1=NC(=NC(=N1)N)N
InChI
InChI=1S/C14H27N5/c1-2-3-4-5-6-7-8-9-10-11-12-17-13(15)19-14(16)18-12/h2-11H2,1H3,(H4,15,16,17,18,19)
InChIKey
MLCIKWISJBFZKS-UHFFFAOYSA-N
Compound name
6-undecyl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

139
Patents

265.22665 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.23393 166.6
[M+Na]+ 288.21587 176.3
[M+NH4]+ 283.26047 172.0
[M+K]+ 304.18981 169.6
[M-H]- 264.21937 167.4
[M+Na-2H]- 286.20132 170.6
[M]+ 265.22610 167.8
[M]- 265.22720 167.8
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