CID 211255

22781-25-5

Structural Information

Molecular Formula
C13H15NO4
SMILES
CNC(=O)OC1=CC=CC2=C1OC3(O2)CCCC3
InChI
InChI=1S/C13H15NO4/c1-14-12(15)16-9-5-4-6-10-11(9)18-13(17-10)7-2-3-8-13/h4-6H,2-3,7-8H2,1H3,(H,14,15)
InChIKey
WWLOOFVJDXLDAS-UHFFFAOYSA-N
Compound name
spiro[1,3-benzodioxole-2,1'-cyclopentane]-4-yl N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.10011 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.10739 154.3
[M+Na]+ 272.08933 163.3
[M+NH4]+ 267.13393 163.7
[M+K]+ 288.06327 160.9
[M-H]- 248.09283 158.9
[M+Na-2H]- 270.07478 158.2
[M]+ 249.09956 156.8
[M]- 249.10066 156.8
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.