CID 3011576

3-[2-(2-adamantyl)-1h-imidazol-4-yl]propanehydrazide

Structural Information

Molecular Formula
C16H24N4O
SMILES
C1C2CC3CC1CC(C2)C3C4=NC=C(N4)CCC(=O)NN
InChI
InChI=1S/C16H24N4O/c17-20-14(21)2-1-13-8-18-16(19-13)15-11-4-9-3-10(6-11)7-12(15)5-9/h8-12,15H,1-7,17H2,(H,18,19)(H,20,21)
InChIKey
XTTVPGVDBHOBBV-UHFFFAOYSA-N
Compound name
3-[2-(2-adamantyl)-1H-imidazol-5-yl]propanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

288.195 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.20228 162.1
[M+Na]+ 311.18422 162.6
[M-H]- 287.18772 156.0
[M+NH4]+ 306.22882 180.5
[M+K]+ 327.15816 158.4
[M+H-H2O]+ 271.19226 154.9
[M+HCOO]- 333.19320 167.5
[M+CH3COO]- 347.20885 168.3
[M+Na-2H]- 309.16967 168.4
[M]+ 288.19445 159.3
[M]- 288.19555 159.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.