CID 62268447

N-(3-aminopropyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide

Structural Information

Molecular Formula
C11H18N2O
SMILES
C1C2CC(C1C=C2)C(=O)NCCCN
InChI
InChI=1S/C11H18N2O/c12-4-1-5-13-11(14)10-7-8-2-3-9(10)6-8/h2-3,8-10H,1,4-7,12H2,(H,13,14)
InChIKey
FEBRVHUNPOGLLL-UHFFFAOYSA-N
Compound name
N-(3-aminopropyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.1419 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.149176 145.5
[M+Na]+ 217.131118 150.7
[M-H]- 193.134624 147.6
[M+NH4]+ 212.175723 169.2
[M+K]+ 233.105058 148.3
[M+H-H2O]+ 177.139160 140.2
[M+HCOO]- 239.140101 168.4
[M+CH3COO]- 253.155751 188.7
[M+Na-2H]- 215.116566 148.0
[M]+ 194.14135142 143.4
[M]- 194.14244858 143.4
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

No patent data available for this compound.