CID 10979337

Urb602

Structural Information

Molecular Formula
C19H21NO2
SMILES
C1CCC(CC1)OC(=O)NC2=CC=CC(=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H21NO2/c21-19(22-18-12-5-2-6-13-18)20-17-11-7-10-16(14-17)15-8-3-1-4-9-15/h1,3-4,7-11,14,18H,2,5-6,12-13H2,(H,20,21)
InChIKey
HHVUFQYJOSFTEH-UHFFFAOYSA-N
Compound name
cyclohexyl N-(3-phenylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

47
References

78
Patents

295.15723 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.164506 169.7
[M+Na]+ 318.146448 172.3
[M-H]- 294.149954 177.9
[M+NH4]+ 313.191053 183.4
[M+K]+ 334.120388 168.2
[M+H-H2O]+ 278.154490 160.2
[M+HCOO]- 340.155431 190.0
[M+CH3COO]- 354.171081 202.9
[M+Na-2H]- 316.131896 173.0
[M]+ 295.15668142 164.4
[M]- 295.15777858 164.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe