CID 60965883

N-(2-aminoethyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide

Structural Information

Molecular Formula
C10H16N2O
SMILES
C1C2CC(C1C=C2)C(=O)NCCN
InChI
InChI=1S/C10H16N2O/c11-3-4-12-10(13)9-6-7-1-2-8(9)5-7/h1-2,7-9H,3-6,11H2,(H,12,13)
InChIKey
LFJIEHZYJJKVLP-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

180.12627 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.13355 140.9
[M+Na]+ 203.11549 146.5
[M-H]- 179.11899 143.2
[M+NH4]+ 198.16009 165.1
[M+K]+ 219.08943 144.4
[M+H-H2O]+ 163.12353 135.7
[M+HCOO]- 225.12447 164.1
[M+CH3COO]- 239.14012 185.7
[M+Na-2H]- 201.10094 144.0
[M]+ 180.12572 138.4
[M]- 180.12682 138.4
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

patents stripe