CID 135770332

N,n'-bis(1,2-dihydroxyiminopropyl)piperazine

Structural Information

Molecular Formula
C10H18N6O4
SMILES
C/C(=N\O)/C(=N\O)/N1CCN(CC1)/C(=N/O)/C(=N/O)/C
InChI
InChI=1S/C10H18N6O4/c1-7(11-17)9(13-19)15-3-5-16(6-4-15)10(14-20)8(2)12-18/h17-20H,3-6H2,1-2H3/b11-7+,12-8+,13-9+,14-10+
InChIKey
YHHODORRZBRECW-DQVHGGFXSA-N
Compound name
(NE)-N-[(1E)-1-[4-[(E)-N-hydroxy-C-[(E)-N-hydroxy-C-methylcarbonimidoyl]carbonimidoyl]piperazin-1-yl]-1-hydroxyiminopropan-2-ylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.13895 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.14623 163.9
[M+Na]+ 309.12817 165.6
[M-H]- 285.13167 164.2
[M+NH4]+ 304.17277 175.1
[M+K]+ 325.10211 166.1
[M+H-H2O]+ 269.13621 155.0
[M+HCOO]- 331.13715 183.1
[M+CH3COO]- 345.15280 207.8
[M+Na-2H]- 307.11362 165.4
[M]+ 286.13840 158.3
[M]- 286.13950 158.3
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

No patent data available for this compound.