CID 56286

Brn 2843342

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CCOC(=O)NNC(C)C1CC2CCC1C2
InChI
InChI=1S/C12H22N2O2/c1-3-16-12(15)14-13-8(2)11-7-9-4-5-10(11)6-9/h8-11,13H,3-7H2,1-2H3,(H,14,15)
InChIKey
AHEIXKMVTNEBKO-UHFFFAOYSA-N
Compound name
ethyl N-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.175396 155.5
[M+Na]+ 249.157338 158.8
[M-H]- 225.160844 157.6
[M+NH4]+ 244.201943 177.9
[M+K]+ 265.131278 157.8
[M+H-H2O]+ 209.165380 150.1
[M+HCOO]- 271.166321 176.3
[M+CH3COO]- 285.181971 195.0
[M+Na-2H]- 247.142786 156.4
[M]+ 226.16757142 153.9
[M]- 226.16866858 153.9
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.