CID 135489581

Brn 0486909

Structural Information

Molecular Formula
C17H26FN3
SMILES
CCN(CC)CCN=C1CC(C(N1)C)C2=CC=C(C=C2)F
InChI
InChI=1S/C17H26FN3/c1-4-21(5-2)11-10-19-17-12-16(13(3)20-17)14-6-8-15(18)9-7-14/h6-9,13,16H,4-5,10-12H2,1-3H3,(H,19,20)
InChIKey
MGPXGMMUBFBETD-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[[4-(4-fluorophenyl)-5-methylpyrrolidin-2-ylidene]amino]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.2111 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.218376 171.9
[M+Na]+ 314.200318 176.6
[M-H]- 290.203824 176.6
[M+NH4]+ 309.244923 188.1
[M+K]+ 330.174258 172.7
[M+H-H2O]+ 274.208360 162.2
[M+HCOO]- 336.209301 193.5
[M+CH3COO]- 350.224951 212.1
[M+Na-2H]- 312.185766 171.2
[M]+ 291.21055142 169.5
[M]- 291.21164858 169.5
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.