CID 9587903

Brn 0672861

Structural Information

Molecular Formula
C10H15N5O3
SMILES
CN1C(=CN=C1[N+](=O)[O-])/C=N/N2CCC(CC2)O
InChI
InChI=1S/C10H15N5O3/c1-13-8(6-11-10(13)15(17)18)7-12-14-4-2-9(16)3-5-14/h6-7,9,16H,2-5H2,1H3/b12-7+
InChIKey
RGSDLKYGWFMEDB-KPKJPENVSA-N
Compound name
1-[(E)-(3-methyl-2-nitroimidazol-4-yl)methylideneamino]piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.1175 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.12478 154.0
[M+Na]+ 276.10672 164.1
[M+NH4]+ 271.15132 159.6
[M+K]+ 292.08066 164.2
[M-H]- 252.11022 156.2
[M+Na-2H]- 274.09217 158.1
[M]+ 253.11695 155.4
[M]- 253.11805 155.4
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.