CID 16072509

N-[(z)-[2-(2-adamantyl)-4-quinolyl]methyleneamino]formamide

Structural Information

Molecular Formula
C21H23N3O
SMILES
C1C2CC3CC1CC(C2)C3C4=NC5=CC=CC=C5C(=C4)/C=N\NC=O
InChI
InChI=1S/C21H23N3O/c25-12-23-22-11-17-10-20(24-19-4-2-1-3-18(17)19)21-15-6-13-5-14(8-15)9-16(21)7-13/h1-4,10-16,21H,5-9H2,(H,23,25)/b22-11-
InChIKey
ORPQEDCZCVYZRT-JJFYIABZSA-N
Compound name
N-[(Z)-[2-(2-adamantyl)quinolin-4-yl]methylideneamino]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

333.1841 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.19138 167.7
[M+Na]+ 356.17332 168.6
[M-H]- 332.17682 166.1
[M+NH4]+ 351.21792 185.4
[M+K]+ 372.14726 163.3
[M+H-H2O]+ 316.18136 157.0
[M+HCOO]- 378.18230 175.6
[M+CH3COO]- 392.19795 174.3
[M+Na-2H]- 354.15877 178.6
[M]+ 333.18355 167.4
[M]- 333.18465 167.4
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.