CID 16769511

N-(prop-2-yn-1-yl)piperidine-4-carboxamide hydrochloride

Structural Information

Molecular Formula
C9H14N2O
SMILES
C#CCNC(=O)C1CCNCC1
InChI
InChI=1S/C9H14N2O/c1-2-5-11-9(12)8-3-6-10-7-4-8/h1,8,10H,3-7H2,(H,11,12)
InChIKey
UAWZKMNSQBDMRZ-UHFFFAOYSA-N
Compound name
N-prop-2-ynylpiperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

166.11061 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.11789 138.2
[M+Na]+ 189.09983 144.1
[M-H]- 165.10333 136.7
[M+NH4]+ 184.14443 153.8
[M+K]+ 205.07377 140.5
[M+H-H2O]+ 149.10787 125.6
[M+HCOO]- 211.10881 150.7
[M+CH3COO]- 225.12446 185.5
[M+Na-2H]- 187.08528 141.2
[M]+ 166.11006 126.3
[M]- 166.11116 126.3
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