CID 156601176

Hmmm tp243

Structural Information

Molecular Formula
C8H14N6O3
SMILES
COCN(COC)C1=NC(=NC(=N1)NC=O)N
InChI
InChI=1S/C8H14N6O3/c1-16-4-14(5-17-2)8-12-6(9)11-7(13-8)10-3-15/h3H,4-5H2,1-2H3,(H3,9,10,11,12,13,15)
InChIKey
QJQMZQYWVWCKJV-UHFFFAOYSA-N
Compound name
N-[4-amino-6-[bis(methoxymethyl)amino]-1,3,5-triazin-2-yl]formamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

242.11273 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.120006 151.2
[M+Na]+ 265.101948 158.5
[M-H]- 241.105454 152.3
[M+NH4]+ 260.146553 164.3
[M+K]+ 281.075888 158.2
[M+H-H2O]+ 225.109990 141.6
[M+HCOO]- 287.110931 176.0
[M+CH3COO]- 301.126581 202.2
[M+Na-2H]- 263.087396 158.3
[M]+ 242.11218142 154.6
[M]- 242.11327858 154.6
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

No patent data available for this compound.