CID 24510

Cyclohexyl anthranilate

Structural Information

Molecular Formula
C13H17NO2
SMILES
C1CCC(CC1)OC(=O)C2=CC=CC=C2N
InChI
InChI=1S/C13H17NO2/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7,14H2
InChIKey
KFEZETDKFSMLMG-UHFFFAOYSA-N
Compound name
cyclohexyl 2-aminobenzoate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

374
Patents

219.12593 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.13321 150.6
[M+Na]+ 242.11515 161.6
[M+NH4]+ 237.15975 159.1
[M+K]+ 258.08909 155.2
[M-H]- 218.11865 154.9
[M+Na-2H]- 240.10060 157.5
[M]+ 219.12538 153.1
[M]- 219.12648 153.1
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