CID 6450973

1-(2ohetome)-6phvinylt

Structural Information

Molecular Formula
C16H18N2O4
SMILES
CC1=C(N(C(=O)NC1=O)COCCO)/C=C\C2=CC=CC=C2
InChI
InChI=1S/C16H18N2O4/c1-12-14(8-7-13-5-3-2-4-6-13)18(11-22-10-9-19)16(21)17-15(12)20/h2-8,19H,9-11H2,1H3,(H,17,20,21)/b8-7-
InChIKey
GRMHFNIUCCXKAG-FPLPWBNLSA-N
Compound name
1-(2-hydroxyethoxymethyl)-5-methyl-6-[(Z)-2-phenylethenyl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

302.12665 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.13393 169.0
[M+Na]+ 325.11587 178.1
[M-H]- 301.11937 170.9
[M+NH4]+ 320.16047 180.3
[M+K]+ 341.08981 172.1
[M+H-H2O]+ 285.12391 160.1
[M+HCOO]- 347.12485 188.3
[M+CH3COO]- 361.14050 198.7
[M+Na-2H]- 323.10132 172.2
[M]+ 302.12610 171.1
[M]- 302.12720 171.1
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.