CID 209549

Urea, 1-(p-methoxyphenyl)-3-(1-methyl-3-pyrrolidinyl)-

Structural Information

Molecular Formula
C13H19N3O2
SMILES
CN1CCC(C1)NC(=O)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C13H19N3O2/c1-16-8-7-11(9-16)15-13(17)14-10-3-5-12(18-2)6-4-10/h3-6,11H,7-9H2,1-2H3,(H2,14,15,17)
InChIKey
OUZCSKAIOQDHEW-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-3-(1-methylpyrrolidin-3-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

249.14772 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.154996 157.0
[M+Na]+ 272.136938 162.0
[M-H]- 248.140444 162.2
[M+NH4]+ 267.181543 174.0
[M+K]+ 288.110878 159.7
[M+H-H2O]+ 232.144980 148.8
[M+HCOO]- 294.145921 180.1
[M+CH3COO]- 308.161571 197.2
[M+Na-2H]- 270.122386 159.6
[M]+ 249.14717142 154.9
[M]- 249.14826858 154.9
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