CID 24842153

Brn 0244174

Structural Information

Molecular Formula
C15H24N2O2
SMILES
CC1=CC=CC=C1N2CCN(C(C2)COC)CCO
InChI
InChI=1S/C15H24N2O2/c1-13-5-3-4-6-15(13)17-8-7-16(9-10-18)14(11-17)12-19-2/h3-6,14,18H,7-12H2,1-2H3
InChIKey
LQJGZKRPFRBLSW-UHFFFAOYSA-N
Compound name
2-[2-(methoxymethyl)-4-(2-methylphenyl)piperazin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.18378 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.19106 165.1
[M+Na]+ 287.17300 170.4
[M-H]- 263.17650 166.8
[M+NH4]+ 282.21760 178.4
[M+K]+ 303.14694 166.7
[M+H-H2O]+ 247.18104 156.1
[M+HCOO]- 309.18198 181.0
[M+CH3COO]- 323.19763 196.3
[M+Na-2H]- 285.15845 166.9
[M]+ 264.18323 163.4
[M]- 264.18433 163.4
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.