CID 2761408

155295-47-9

Structural Information

Molecular Formula
C9H18N2O
SMILES
CC(C)(C)C(=O)N1CCNCC1
InChI
InChI=1S/C9H18N2O/c1-9(2,3)8(12)11-6-4-10-5-7-11/h10H,4-7H2,1-3H3
InChIKey
FPXOBQQMHSMJMN-UHFFFAOYSA-N
Compound name
2,2-dimethyl-1-piperazin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

324
Patents

170.1419 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.149176 142.1
[M+Na]+ 193.131118 146.7
[M-H]- 169.134624 140.7
[M+NH4]+ 188.175723 159.1
[M+K]+ 209.105058 145.2
[M+H-H2O]+ 153.139160 135.6
[M+HCOO]- 215.140101 156.1
[M+CH3COO]- 229.155751 176.1
[M+Na-2H]- 191.116566 146.3
[M]+ 170.14135142 136.3
[M]- 170.14244858 136.3
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