CID 3063912

5-norbornene-2-acetamide, n-tert-butyl-3-cyanomethyl-

Structural Information

Molecular Formula
C15H22N2O
SMILES
CC(C)(C)NC(=O)CC1C2CC(C1CC#N)C=C2
InChI
InChI=1S/C15H22N2O/c1-15(2,3)17-14(18)9-13-11-5-4-10(8-11)12(13)6-7-16/h4-5,10-13H,6,8-9H2,1-3H3,(H,17,18)
InChIKey
DSDRJKHECCDQFJ-UHFFFAOYSA-N
Compound name
N-tert-butyl-2-[3-(cyanomethyl)-2-bicyclo[2.2.1]hept-5-enyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.17322 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.18050 160.8
[M+Na]+ 269.16244 167.6
[M+NH4]+ 264.20704 165.1
[M+K]+ 285.13638 162.4
[M-H]- 245.16594 153.3
[M+Na-2H]- 267.14789 159.0
[M]+ 246.17267 158.6
[M]- 246.17377 158.6
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.