CID 378759

Nsc661915

Structural Information

Molecular Formula
C17H19F2N
SMILES
C1C2CC3CC1CC(C2)(C3)N=CC4=C(C=CC(=C4)F)F
InChI
InChI=1S/C17H19F2N/c18-15-1-2-16(19)14(6-15)10-20-17-7-11-3-12(8-17)5-13(4-11)9-17/h1-2,6,10-13H,3-5,7-9H2
InChIKey
RNBVJGHHGDCYQR-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)-1-(2,5-difluorophenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.14856 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.15584 161.4
[M+Na]+ 298.13778 164.9
[M-H]- 274.14128 158.8
[M+NH4]+ 293.18238 184.8
[M+K]+ 314.11172 159.3
[M+H-H2O]+ 258.14582 150.9
[M+HCOO]- 320.14676 169.2
[M+CH3COO]- 334.16241 169.5
[M+Na-2H]- 296.12323 170.4
[M]+ 275.14801 158.6
[M]- 275.14911 158.6
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.