CID 28787674

1-(3-hydroxyphenyl)-3-propylurea

Structural Information

Molecular Formula
C10H14N2O2
SMILES
CCCNC(=O)NC1=CC(=CC=C1)O
InChI
InChI=1S/C10H14N2O2/c1-2-6-11-10(14)12-8-4-3-5-9(13)7-8/h3-5,7,13H,2,6H2,1H3,(H2,11,12,14)
InChIKey
FSZIEBLZDZPOPX-UHFFFAOYSA-N
Compound name
1-(3-hydroxyphenyl)-3-propylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

194.10553 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 142.5
[M+Na]+ 217.09475 148.4
[M-H]- 193.09825 144.9
[M+NH4]+ 212.13935 160.8
[M+K]+ 233.06869 146.2
[M+H-H2O]+ 177.10279 136.1
[M+HCOO]- 239.10373 167.0
[M+CH3COO]- 253.11938 185.5
[M+Na-2H]- 215.08020 148.3
[M]+ 194.10498 141.1
[M]- 194.10608 141.1
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

patents stripe