CID 97267

4-(4-morpholinyl)-1,3,5-triazin-2-amine

Structural Information

Molecular Formula
C7H11N5O
SMILES
C1COCCN1C2=NC=NC(=N2)N
InChI
InChI=1S/C7H11N5O/c8-6-9-5-10-7(11-6)12-1-3-13-4-2-12/h5H,1-4H2,(H2,8,9,10,11)
InChIKey
QEJUSHCHCOTTPE-UHFFFAOYSA-N
Compound name
4-morpholin-4-yl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

41
Patents

181.09636 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.10364 140.5
[M+Na]+ 204.08558 147.4
[M-H]- 180.08908 141.4
[M+NH4]+ 199.13018 152.6
[M+K]+ 220.05952 145.7
[M+H-H2O]+ 164.09362 130.3
[M+HCOO]- 226.09456 157.1
[M+CH3COO]- 240.11021 151.4
[M+Na-2H]- 202.07103 148.4
[M]+ 181.09581 135.5
[M]- 181.09691 135.5
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