CID 31059

Cl 71366

Structural Information

Molecular Formula
C16H27N3O
SMILES
CN(C)CCCN1CCN(CC1)C2=CC=C(C=C2)OC
InChI
InChI=1S/C16H27N3O/c1-17(2)9-4-10-18-11-13-19(14-12-18)15-5-7-16(20-3)8-6-15/h5-8H,4,9-14H2,1-3H3
InChIKey
MOYBVKHVBFCEQA-UHFFFAOYSA-N
Compound name
3-[4-(4-methoxyphenyl)piperazin-1-yl]-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.21542 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.22270 169.1
[M+Na]+ 300.20464 180.6
[M+NH4]+ 295.24924 176.7
[M+K]+ 316.17858 173.3
[M-H]- 276.20814 173.0
[M+Na-2H]- 298.19009 175.7
[M]+ 277.21487 171.7
[M]- 277.21597 171.7
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

No patent data available for this compound.