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

61
Patents

208.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 147.6
[M+Na]+ 231.11041 153.4
[M-H]- 207.11391 148.3
[M+NH4]+ 226.15501 162.2
[M+K]+ 247.08435 149.7
[M+H-H2O]+ 191.11845 139.5
[M+HCOO]- 253.11939 163.4
[M+CH3COO]- 267.13504 180.7
[M+Na-2H]- 229.09586 151.9
[M]+ 208.12064 142.3
[M]- 208.12174 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