CID 6451759

2-(ethylamino)-4-(isopropylamino)-s-triazine

Structural Information

Molecular Formula
C8H15N5
SMILES
CCNC1=NC(=NC=N1)NC(C)C
InChI
InChI=1S/C8H15N5/c1-4-9-7-10-5-11-8(13-7)12-6(2)3/h5-6H,4H2,1-3H3,(H2,9,10,11,12,13)
InChIKey
DWWKJVDRGAIXJI-UHFFFAOYSA-N
Compound name
4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

34
Patents

181.13275 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.14003 141.6
[M+Na]+ 204.12197 148.6
[M-H]- 180.12547 141.3
[M+NH4]+ 199.16657 157.2
[M+K]+ 220.09591 146.7
[M+H-H2O]+ 164.13001 133.0
[M+HCOO]- 226.13095 163.7
[M+CH3COO]- 240.14660 188.3
[M+Na-2H]- 202.10742 149.4
[M]+ 181.13220 141.0
[M]- 181.13330 141.0
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.