CID 515696

Schembl11830304

Structural Information

Molecular Formula
C26H32N2O2
SMILES
CC(CN(C)C)OC1=CC2=C(C=C1)C3=CC=CC4=C(C=CC2=C43)OC(C)CN(C)C
InChI
InChI=1S/C26H32N2O2/c1-17(15-27(3)4)29-19-10-11-20-21-8-7-9-23-25(30-18(2)16-28(5)6)13-12-22(26(21)23)24(20)14-19/h7-14,17-18H,15-16H2,1-6H3
InChIKey
VMAJILONDMSZPV-UHFFFAOYSA-N
Compound name
2-[4-[1-(dimethylamino)propan-2-yloxy]fluoranthen-8-yl]oxy-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

404.24637 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.25365 205.1
[M+Na]+ 427.23559 209.3
[M-H]- 403.23909 212.3
[M+NH4]+ 422.28019 221.4
[M+K]+ 443.20953 206.9
[M+H-H2O]+ 387.24363 196.2
[M+HCOO]- 449.24457 224.6
[M+CH3COO]- 463.26022 242.5
[M+Na-2H]- 425.22104 205.0
[M]+ 404.24582 213.3
[M]- 404.24692 213.3
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.