CID 25090883

84100-25-4

Structural Information

Molecular Formula
C9H14N2O2
SMILES
C=CNC(=O)ON=C1CCCCC1
InChI
InChI=1S/C9H14N2O2/c1-2-10-9(12)13-11-8-6-4-3-5-7-8/h2H,1,3-7H2,(H,10,12)
InChIKey
JMUBBNIWBAJXBJ-UHFFFAOYSA-N
Compound name
(cyclohexylideneamino) N-ethenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.10553 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.112806 139.7
[M+Na]+ 205.094748 143.4
[M-H]- 181.098254 143.5
[M+NH4]+ 200.139353 159.2
[M+K]+ 221.068688 142.7
[M+H-H2O]+ 165.102790 133.0
[M+HCOO]- 227.103731 163.5
[M+CH3COO]- 241.119381 185.1
[M+Na-2H]- 203.080196 144.7
[M]+ 182.10498142 135.5
[M]- 182.10607858 135.5
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.