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]+ 357.144476 193.2
[M+Na]+ 379.126418 199.6
[M-H]- 355.129924 196.1
[M+NH4]+ 374.171023 198.4
[M+K]+ 395.100358 201.0
[M+H-H2O]+ 339.134460 184.3
[M+HCOO]- 401.135401 201.6
[M+CH3COO]- 415.151051 219.3
[M+Na-2H]- 377.111866 194.5
[M]+ 356.13665142 204.8
[M]- 356.13774858 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.