CID 62535496

3-methoxy-2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine

Structural Information

Molecular Formula
C12H27N3O
SMILES
CC(C)N1CCN(CC1)C(C)(CN)COC
InChI
InChI=1S/C12H27N3O/c1-11(2)14-5-7-15(8-6-14)12(3,9-13)10-16-4/h11H,5-10,13H2,1-4H3
InChIKey
HLVRWVOTFDHZFZ-UHFFFAOYSA-N
Compound name
3-methoxy-2-methyl-2-(4-propan-2-ylpiperazin-1-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.21541 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.22269 159.8
[M+Na]+ 252.20463 163.1
[M-H]- 228.20813 158.9
[M+NH4]+ 247.24923 174.7
[M+K]+ 268.17857 162.0
[M+H-H2O]+ 212.21267 152.2
[M+HCOO]- 274.21361 174.4
[M+CH3COO]- 288.22926 195.5
[M+Na-2H]- 250.19008 161.5
[M]+ 229.21486 156.5
[M]- 229.21596 156.5
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

No patent data available for this compound.