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

2
Patents

182.1419 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.149176 142.7
[M+Na]+ 205.131118 147.2
[M-H]- 181.134624 145.4
[M+NH4]+ 200.175723 161.5
[M+K]+ 221.105058 146.8
[M+H-H2O]+ 165.139160 135.8
[M+HCOO]- 227.140101 162.4
[M+CH3COO]- 241.155751 188.0
[M+Na-2H]- 203.116566 145.1
[M]+ 182.14135142 139.4
[M]- 182.14244858 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

patents stripe