CID 38954

41734-56-9

Structural Information

Molecular Formula
C16H21FN2
SMILES
CN(C)CCN1C2=C(CCCC2)C3=C1C=CC(=C3)F
InChI
InChI=1S/C16H21FN2/c1-18(2)9-10-19-15-6-4-3-5-13(15)14-11-12(17)7-8-16(14)19/h7-8,11H,3-6,9-10H2,1-2H3
InChIKey
MGJZQUCXZSXTOC-UHFFFAOYSA-N
Compound name
2-(6-fluoro-1,2,3,4-tetrahydrocarbazol-9-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.16888 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.17616 160.2
[M+Na]+ 283.15810 168.3
[M-H]- 259.16160 164.1
[M+NH4]+ 278.20270 180.4
[M+K]+ 299.13204 164.1
[M+H-H2O]+ 243.16614 151.7
[M+HCOO]- 305.16708 180.5
[M+CH3COO]- 319.18273 172.2
[M+Na-2H]- 281.14355 163.9
[M]+ 260.16833 160.4
[M]- 260.16943 160.4
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.