CID 22509

6132-26-9

Structural Information

Molecular Formula
C13H15NO2
SMILES
CN(C1=CC=CC=C1)C(=O)OC2=CCCC2
InChI
InChI=1S/C13H15NO2/c1-14(11-7-3-2-4-8-11)13(15)16-12-9-5-6-10-12/h2-4,7-9H,5-6,10H2,1H3
InChIKey
WYFVBOXMBQCLDL-UHFFFAOYSA-N
Compound name
cyclopenten-1-yl N-methyl-N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.11028 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.11756 149.2
[M+Na]+ 240.09950 154.4
[M-H]- 216.10300 157.0
[M+NH4]+ 235.14410 169.3
[M+K]+ 256.07344 153.5
[M+H-H2O]+ 200.10754 141.9
[M+HCOO]- 262.10848 174.5
[M+CH3COO]- 276.12413 190.3
[M+Na-2H]- 238.08495 152.7
[M]+ 217.10973 149.2
[M]- 217.11083 149.2
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.