CID 71738795

Schembl18083930

Structural Information

Molecular Formula
C14H24N4O
SMILES
CN1C=CN=C1CCC(=O)N2CCC(CC2)N(C)C
InChI
InChI=1S/C14H24N4O/c1-16(2)12-6-9-18(10-7-12)14(19)5-4-13-15-8-11-17(13)3/h8,11-12H,4-7,9-10H2,1-3H3
InChIKey
RZZZOGIAUNCGTG-UHFFFAOYSA-N
Compound name
1-[4-(dimethylamino)piperidin-1-yl]-3-(1-methylimidazol-2-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

264.195 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.20228 165.3
[M+Na]+ 287.18422 169.9
[M-H]- 263.18772 168.5
[M+NH4]+ 282.22882 179.8
[M+K]+ 303.15816 168.1
[M+H-H2O]+ 247.19226 155.4
[M+HCOO]- 309.19320 183.1
[M+CH3COO]- 323.20885 203.1
[M+Na-2H]- 285.16967 164.9
[M]+ 264.19445 163.7
[M]- 264.19555 163.7
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