CID 9570765

2,8-adamantanedione, dioxime

Structural Information

Molecular Formula
C10H14N2O2
SMILES
C1C2/C(=N\O)/C3/C(=N/O)/C(C2)CC1C3
InChI
InChI=1S/C10H14N2O2/c13-11-9-6-1-5-2-7(4-6)10(12-14)8(9)3-5/h5-8,13-14H,1-4H2/b11-9+,12-10+
InChIKey
PKPCEQGXCIOJBY-WGDLNXRISA-N
Compound name
(NE)-N-[(4E)-4-hydroxyimino-2-adamantylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.10553 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 136.6
[M+Na]+ 217.09475 139.4
[M-H]- 193.09825 132.5
[M+NH4]+ 212.13935 160.8
[M+K]+ 233.06869 137.4
[M+H-H2O]+ 177.10279 131.7
[M+HCOO]- 239.10373 147.5
[M+CH3COO]- 253.11938 146.3
[M+Na-2H]- 215.08020 148.7
[M]+ 194.10498 136.1
[M]- 194.10608 136.1
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.