CID 16794323

1170578-54-7

Structural Information

Molecular Formula
C9H18N2O
SMILES
CC(C)C(=O)NC1CCNCC1
InChI
InChI=1S/C9H18N2O/c1-7(2)9(12)11-8-3-5-10-6-4-8/h7-8,10H,3-6H2,1-2H3,(H,11,12)
InChIKey
BNCQNRLNKWZODO-UHFFFAOYSA-N
Compound name
2-methyl-N-piperidin-4-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

127
Patents

170.1419 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.149176 141.5
[M+Na]+ 193.131118 144.3
[M-H]- 169.134624 141.1
[M+NH4]+ 188.175723 159.1
[M+K]+ 209.105058 142.9
[M+H-H2O]+ 153.139160 134.8
[M+HCOO]- 215.140101 158.3
[M+CH3COO]- 229.155751 179.5
[M+Na-2H]- 191.116566 143.9
[M]+ 170.14135142 134.3
[M]- 170.14244858 134.3
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

patents stripe