CID 3060553

Wp130

Structural Information

Molecular Formula
C7H17N6OP
SMILES
CC1=NN(C(=N1)N)P(=O)(N(C)C)N(C)C
InChI
InChI=1S/C7H17N6OP/c1-6-9-7(8)13(10-6)15(14,11(2)3)12(4)5/h1-5H3,(H2,8,9,10)
InChIKey
HQALKEQVLVBRJT-UHFFFAOYSA-N
Compound name
2-[bis(dimethylamino)phosphoryl]-5-methyl-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.12015 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.12743 152.2
[M+Na]+ 255.10937 159.4
[M-H]- 231.11287 154.0
[M+NH4]+ 250.15397 168.9
[M+K]+ 271.08331 160.8
[M+H-H2O]+ 215.11741 141.5
[M+HCOO]- 277.11835 181.4
[M+CH3COO]- 291.13400 205.5
[M+Na-2H]- 253.09482 153.6
[M]+ 232.11960 154.8
[M]- 232.12070 154.8
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.