CID 89166893

1072896-13-9

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NCCO
InChI
InChI=1S/C15H22N2O2/c1-11(2)12-6-5-7-13(10-12)15(3,4)17-14(19)16-8-9-18/h5-7,10,18H,1,8-9H2,2-4H3,(H2,16,17,19)
InChIKey
KAODWGNGVLOIAS-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethyl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

262.16812 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 164.6
[M+Na]+ 285.15734 172.7
[M+NH4]+ 280.20194 170.2
[M+K]+ 301.13128 168.3
[M-H]- 261.16084 165.1
[M+Na-2H]- 283.14279 168.3
[M]+ 262.16757 165.5
[M]- 262.16867 165.5
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