CID 3060478

78149-98-1

Structural Information

Molecular Formula
C6H14N5O2P
SMILES
CCOP(=O)(N1C(=NC=N1)N)N(C)C
InChI
InChI=1S/C6H14N5O2P/c1-4-13-14(12,10(2)3)11-6(7)8-5-9-11/h5H,4H2,1-3H3,(H2,7,8,9)
InChIKey
YGGVFWMXBPULRR-UHFFFAOYSA-N
Compound name
2-[dimethylamino(ethoxy)phosphoryl]-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.08852 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.09580 146.1
[M+Na]+ 242.07774 153.3
[M+NH4]+ 237.12234 150.7
[M+K]+ 258.05168 153.4
[M-H]- 218.08124 144.4
[M+Na-2H]- 240.06319 149.2
[M]+ 219.08797 146.0
[M]- 219.08907 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.