CID 3685564

N-(1-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2-chloroacetamide

Structural Information

Molecular Formula
C11H18ClNO
SMILES
CC(C1CC2CCC1C2)NC(=O)CCl
InChI
InChI=1S/C11H18ClNO/c1-7(13-11(14)6-12)10-5-8-2-3-9(10)4-8/h7-10H,2-6H2,1H3,(H,13,14)
InChIKey
LARFYGYUBWEGFA-UHFFFAOYSA-N
Compound name
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-2-chloroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.1077 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.114976 155.0
[M+Na]+ 238.096918 160.6
[M-H]- 214.100424 157.2
[M+NH4]+ 233.141523 179.1
[M+K]+ 254.070858 157.0
[M+H-H2O]+ 198.104960 150.9
[M+HCOO]- 260.105901 170.3
[M+CH3COO]- 274.121551 189.4
[M+Na-2H]- 236.082366 154.9
[M]+ 215.10715142 154.3
[M]- 215.10824858 154.3
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.