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]+ 195.112806 136.6
[M+Na]+ 217.094748 139.4
[M-H]- 193.098254 132.5
[M+NH4]+ 212.139353 160.8
[M+K]+ 233.068688 137.4
[M+H-H2O]+ 177.102790 131.7
[M+HCOO]- 239.103731 147.5
[M+CH3COO]- 253.119381 146.3
[M+Na-2H]- 215.080196 148.7
[M]+ 194.10498142 136.1
[M]- 194.10607858 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.