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: 290
Patents: 170.1419 Da
Monoisotopic Mass: 0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	171.14918	142.1
[M+Na]+	193.13112	146.7
[M-H]-	169.13462	140.7
[M+NH4]+	188.17572	159.1
[M+K]+	209.10506	145.2
[M+H-H2O]+	153.13916	135.6
[M+HCOO]-	215.14010	156.1
[M+CH3COO]-	229.15575	176.1
[M+Na-2H]-	191.11657	146.3
[M]+	170.14135	136.3
[M]-	170.14245	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe