CID 18663046

2-methoxy-5-piperazin-1-yl-phenol

Structural Information

Molecular Formula
C11H16N2O2
SMILES
COC1=C(C=C(C=C1)N2CCNCC2)O
InChI
InChI=1S/C11H16N2O2/c1-15-11-3-2-9(8-10(11)14)13-6-4-12-5-7-13/h2-3,8,12,14H,4-7H2,1H3
InChIKey
JEITXSUTZNDIBO-UHFFFAOYSA-N
Compound name
2-methoxy-5-piperazin-1-ylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

208.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.128466 147.6
[M+Na]+ 231.110408 153.4
[M-H]- 207.113914 148.3
[M+NH4]+ 226.155013 162.2
[M+K]+ 247.084348 149.7
[M+H-H2O]+ 191.118450 139.5
[M+HCOO]- 253.119391 163.4
[M+CH3COO]- 267.135041 180.7
[M+Na-2H]- 229.095856 151.9
[M]+ 208.12064142 142.3
[M]- 208.12173858 142.3
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

patents stripe