CID 97379

Urea, 1-cyclohexyl-3-(4-thiazolylmethoxy)-

Structural Information

Molecular Formula
C11H17N3O2S
SMILES
C1CCC(CC1)NC(=O)NOCC2=CSC=N2
InChI
InChI=1S/C11H17N3O2S/c15-11(13-9-4-2-1-3-5-9)14-16-6-10-7-17-8-12-10/h7-9H,1-6H2,(H2,13,14,15)
InChIKey
RJZBNYIYEQOKOI-UHFFFAOYSA-N
Compound name
1-cyclohexyl-3-(1,3-thiazol-4-ylmethoxy)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.10414 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.11142 155.4
[M+Na]+ 278.09336 158.8
[M-H]- 254.09686 159.7
[M+NH4]+ 273.13796 172.1
[M+K]+ 294.06730 156.4
[M+H-H2O]+ 238.10140 147.4
[M+HCOO]- 300.10234 172.6
[M+CH3COO]- 314.11799 193.0
[M+Na-2H]- 276.07881 156.9
[M]+ 255.10359 152.8
[M]- 255.10469 152.8
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.