CID 13037020

(1,2,3,4-tetrahydronaphthalen-1-yl)urea

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1CC(C2=CC=CC=C2C1)NC(=O)N
InChI
InChI=1S/C11H14N2O/c12-11(14)13-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H3,12,13,14)
InChIKey
PLSFSIDDNZKALV-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydronaphthalen-1-ylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

190.11061 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.0
[M+Na]+ 213.09983 151.5
[M+NH4]+ 208.14443 150.0
[M+K]+ 229.07377 145.3
[M-H]- 189.10333 144.6
[M+Na-2H]- 211.08528 146.8
[M]+ 190.11006 143.3
[M]- 190.11116 143.3
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