CID 44146796

N,n,n',n'-tetra(2-hydroxy-3-(methacryloyloxy)propyl)benzenedimethanamine

Structural Information

Molecular Formula
C19H20N2O5
SMILES
CC(=C)C(=O)OC1C2(C3(N1CC4=CC=CC=C4CN23)OC(=O)C(=C)C)O
InChI
InChI=1S/C19H20N2O5/c1-11(2)15(22)25-17-18(24)19(26-16(23)12(3)4)20(17)9-13-7-5-6-8-14(13)10-21(18)19/h5-8,17,24H,1,3,9-10H2,2,4H3
InChIKey
MNQCCYJELIVOJF-UHFFFAOYSA-N
Compound name
[5-hydroxy-4-(2-methylprop-2-enoyloxy)-3,7-diazatetracyclo[7.4.0.03,5.04,7]trideca-1(13),9,11-trien-6-yl] 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.1372 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.14448 193.2
[M+Na]+ 379.12642 199.6
[M-H]- 355.12992 196.1
[M+NH4]+ 374.17102 198.4
[M+K]+ 395.10036 201.0
[M+H-H2O]+ 339.13446 184.3
[M+HCOO]- 401.13540 201.6
[M+CH3COO]- 415.15105 219.3
[M+Na-2H]- 377.11187 194.5
[M]+ 356.13665 204.8
[M]- 356.13775 204.8
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.