CID 18899

Cyclopentyl n-phenylcarbamate

Structural Information

Molecular Formula
C12H15NO2
SMILES
C1CCC(C1)OC(=O)NC2=CC=CC=C2
InChI
InChI=1S/C12H15NO2/c14-12(15-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2,(H,13,14)
InChIKey
XKERVEWMWMNGJA-UHFFFAOYSA-N
Compound name
cyclopentyl N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

31
Patents

205.11028 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.11756 145.7
[M+Na]+ 228.09950 150.2
[M-H]- 204.10300 151.8
[M+NH4]+ 223.14410 165.6
[M+K]+ 244.07344 148.3
[M+H-H2O]+ 188.10754 138.7
[M+HCOO]- 250.10848 169.4
[M+CH3COO]- 264.12413 184.2
[M+Na-2H]- 226.08495 149.6
[M]+ 205.10973 142.6
[M]- 205.11083 142.6
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