CID 66682

91-77-0

Structural Information

Molecular Formula
C9H14N6
SMILES
C=CCN(CC=C)C1=NC(=NC(=N1)N)N
InChI
InChI=1S/C9H14N6/c1-3-5-15(6-4-2)9-13-7(10)12-8(11)14-9/h3-4H,1-2,5-6H2,(H4,10,11,12,13,14)
InChIKey
ROHTVIURAJBDES-UHFFFAOYSA-N
Compound name
2-N,2-N-bis(prop-2-enyl)-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

2650
Patents

206.12799 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.13527 145.9
[M+Na]+ 229.11721 155.7
[M+NH4]+ 224.16181 151.3
[M+K]+ 245.09115 150.9
[M-H]- 205.12071 146.9
[M+Na-2H]- 227.10266 150.9
[M]+ 206.12744 147.1
[M]- 206.12854 147.1
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