CID 43616749

1-[4-(dimethylamino)piperidin-1-yl]prop-2-en-1-one

Structural Information

Molecular Formula
C10H18N2O
SMILES
CN(C)C1CCN(CC1)C(=O)C=C
InChI
InChI=1S/C10H18N2O/c1-4-10(13)12-7-5-9(6-8-12)11(2)3/h4,9H,1,5-8H2,2-3H3
InChIKey
YLXQICVLZWJHGZ-UHFFFAOYSA-N
Compound name
1-[4-(dimethylamino)piperidin-1-yl]prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.1419 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.14918 142.7
[M+Na]+ 205.13112 147.2
[M-H]- 181.13462 145.4
[M+NH4]+ 200.17572 161.5
[M+K]+ 221.10506 146.8
[M+H-H2O]+ 165.13916 135.8
[M+HCOO]- 227.14010 162.4
[M+CH3COO]- 241.15575 188.0
[M+Na-2H]- 203.11657 145.1
[M]+ 182.14135 139.4
[M]- 182.14245 139.4
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.