CID 66682

Diallylmelamine

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

2811
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 148.1
[M+Na]+ 229.11721 155.8
[M-H]- 205.12071 148.5
[M+NH4]+ 224.16181 162.6
[M+K]+ 245.09115 152.6
[M+H-H2O]+ 189.12525 139.1
[M+HCOO]- 251.12619 171.5
[M+CH3COO]- 265.14184 197.2
[M+Na-2H]- 227.10266 153.4
[M]+ 206.12744 146.0
[M]- 206.12854 146.0
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