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

3
Patents

358.1601 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.167376 179.1
[M+Na]+ 381.149318 181.1
[M-H]- 357.152824 175.0
[M+NH4]+ 376.193923 184.2
[M+K]+ 397.123258 181.1
[M+H-H2O]+ 341.157360 169.8
[M+HCOO]- 403.158301 193.9
[M+CH3COO]- 417.173951 219.0
[M+Na-2H]- 379.134766 178.9
[M]+ 358.15955142 179.0
[M]- 358.16064858 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