CID 3057354

Tetramethylol-melamin-dioxy-propylen [german]

Structural Information

Molecular Formula
C13H22N6O6
SMILES
C=CC(N(C1=NC(=NC(=N1)N(CO)CO)N(CO)CO)C(C=C)O)O
InChI
InChI=1S/C13H22N6O6/c1-3-9(24)19(10(25)4-2)13-15-11(17(5-20)6-21)14-12(16-13)18(7-22)8-23/h3-4,9-10,20-25H,1-2,5-8H2
InChIKey
JANNWOSDBXOFPU-UHFFFAOYSA-N
Compound name
1-[[4,6-bis[bis(hydroxymethyl)amino]-1,3,5-triazin-2-yl]-(1-hydroxyprop-2-enyl)amino]prop-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

358.1601 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.16738 179.1
[M+Na]+ 381.14932 181.1
[M-H]- 357.15282 175.0
[M+NH4]+ 376.19392 184.2
[M+K]+ 397.12326 181.1
[M+H-H2O]+ 341.15736 169.8
[M+HCOO]- 403.15830 193.9
[M+CH3COO]- 417.17395 219.0
[M+Na-2H]- 379.13477 178.9
[M]+ 358.15955 179.0
[M]- 358.16065 179.0
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

patents stripe