CID 154814146

2219339-64-5

Structural Information

Molecular Formula
C11H15N3O2
SMILES
COC1=CC=CC=C1N2CCN(CC2)N=O
InChI
InChI=1S/C11H15N3O2/c1-16-11-5-3-2-4-10(11)13-6-8-14(12-15)9-7-13/h2-5H,6-9H2,1H3
InChIKey
VKBXEOUCIQLIHX-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenyl)-4-nitrosopiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.11642 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12370 148.4
[M+Na]+ 244.10564 154.8
[M-H]- 220.10914 153.2
[M+NH4]+ 239.15024 164.1
[M+K]+ 260.07958 153.2
[M+H-H2O]+ 204.11368 139.0
[M+HCOO]- 266.11462 169.9
[M+CH3COO]- 280.13027 192.4
[M+Na-2H]- 242.09109 154.6
[M]+ 221.11587 147.2
[M]- 221.11697 147.2
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.