CID 101467493

1166232-68-3

Structural Information

Molecular Formula
C14H16N4O4
SMILES
C1=CC2=C(C=CC=C2NC(=O)CON)C(=C1)NC(=O)CON
InChI
InChI=1S/C14H16N4O4/c15-21-7-13(19)17-11-5-1-3-9-10(11)4-2-6-12(9)18-14(20)8-22-16/h1-6H,7-8,15-16H2,(H,17,19)(H,18,20)
InChIKey
MLWDZDBSRKXTQH-UHFFFAOYSA-N
Compound name
2-aminooxy-N-[5-[(2-aminooxyacetyl)amino]naphthalen-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

304.11716 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.12444 164.0
[M+Na]+ 327.10638 168.6
[M-H]- 303.10988 167.3
[M+NH4]+ 322.15098 177.8
[M+K]+ 343.08032 166.9
[M+H-H2O]+ 287.11442 155.7
[M+HCOO]- 349.11536 188.7
[M+CH3COO]- 363.13101 213.3
[M+Na-2H]- 325.09183 169.0
[M]+ 304.11661 163.3
[M]- 304.11771 163.3
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