CID 168313189

[99mtc]-cbpao

Structural Information

Molecular Formula
C14H28N4O2
SMILES
CC(C(=NO)C)NCC1(CCC1)CNC(C)C(=NO)C
InChI
InChI=1S/C14H28N4O2/c1-10(12(3)17-19)15-8-14(6-5-7-14)9-16-11(2)13(4)18-20/h10-11,15-16,19-20H,5-9H2,1-4H3
InChIKey
NISDJNMEWBHIOU-UHFFFAOYSA-N
Compound name
N-[3-[[1-[(3-hydroxyiminobutan-2-ylamino)methyl]cyclobutyl]methylamino]butan-2-ylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.22122 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.228496 183.0
[M+Na]+ 307.210438 180.9
[M-H]- 283.213944 184.7
[M+NH4]+ 302.255043 191.8
[M+K]+ 323.184378 184.5
[M+H-H2O]+ 267.218480 169.5
[M+HCOO]- 329.219421 202.2
[M+CH3COO]- 343.235071 215.8
[M+Na-2H]- 305.195886 181.2
[M]+ 284.22067142 188.0
[M]- 284.22176858 188.0
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.