CID 212539

24493-82-1

Structural Information

Molecular Formula
C18H19NSe
SMILES
CN(C)CCC=C1C2=CC=CC=C2[Se]C3=CC=CC=C31
InChI
InChI=1S/C18H19NSe/c1-19(2)13-7-10-14-15-8-3-5-11-17(15)20-18-12-6-4-9-16(14)18/h3-6,8-12H,7,13H2,1-2H3
InChIKey
UJSKXTZHHNELBO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-selenoxanthen-9-ylidenepropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.06827 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.07555 173.9
[M+Na]+ 352.05749 179.6
[M-H]- 328.06099 179.1
[M+NH4]+ 347.10209 192.2
[M+K]+ 368.03143 174.2
[M+H-H2O]+ 312.06553 165.2
[M+HCOO]- 374.06647 194.2
[M+CH3COO]- 388.08212 208.2
[M+Na-2H]- 350.04294 178.8
[M]+ 329.06772 173.5
[M]- 329.06882 173.5
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.