CID 24832209

Erl 239

Structural Information

Molecular Formula
C13H24N2O
SMILES
CCN(CC)CC(=O)N[C@@H]1C[C@@H]2CC[C@H]1C2
InChI
InChI=1S/C13H24N2O/c1-3-15(4-2)9-13(16)14-12-8-10-5-6-11(12)7-10/h10-12H,3-9H2,1-2H3,(H,14,16)/t10-,11+,12-/m1/s1
InChIKey
IMSKVNYCRKPXRW-GRYCIOLGSA-N
Compound name
N-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-(diethylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.18886 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.19614 157.6
[M+Na]+ 247.17808 160.9
[M-H]- 223.18158 160.8
[M+NH4]+ 242.22268 180.8
[M+K]+ 263.15202 159.9
[M+H-H2O]+ 207.18612 151.7
[M+HCOO]- 269.18706 179.3
[M+CH3COO]- 283.20271 199.1
[M+Na-2H]- 245.16353 158.1
[M]+ 224.18831 156.8
[M]- 224.18941 156.8
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.