CID 2736173

59955-93-0

Structural Information

Molecular Formula

C₁₂H₂₇N₃

SMILES

CC(C)N(CCN1CCNCC1)C(C)C

InChI

InChI=1S/C12H27N3/c1-11(2)15(12(3)4)10-9-14-7-5-13-6-8-14/h11-13H,5-10H2,1-4H3

InChIKey

IDWCYRNCJHGJAL-UHFFFAOYSA-N

Compound name

N-(2-piperazin-1-ylethyl)-N-propan-2-ylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 99
Patents: 213.2205 Da
Monoisotopic Mass: 1.2
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]+	214.22778	156.9
[M+Na]+	236.20972	158.3
[M-H]-	212.21322	156.0
[M+NH4]+	231.25432	172.1
[M+K]+	252.18366	157.6
[M+H-H2O]+	196.21776	148.6
[M+HCOO]-	258.21870	171.5
[M+CH3COO]-	272.23435	194.3
[M+Na-2H]-	234.19517	157.2
[M]+	213.21995	152.0
[M]-	213.22105	152.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe