CID 6447145

2-(methylaminobutoxy)stilbene hydrochloride

Structural Information

Molecular Formula
C19H23NO
SMILES
CNCCCCOC1=CC=CC=C1/C=C/C2=CC=CC=C2
InChI
InChI=1S/C19H23NO/c1-20-15-7-8-16-21-19-12-6-5-11-18(19)14-13-17-9-3-2-4-10-17/h2-6,9-14,20H,7-8,15-16H2,1H3/b14-13+
InChIKey
XKSIJOFIGMHPMK-BUHFOSPRSA-N
Compound name
N-methyl-4-[2-[(E)-2-phenylethenyl]phenoxy]butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

281.17798 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.18526 170.6
[M+Na]+ 304.16720 184.3
[M+NH4]+ 299.21180 179.1
[M+K]+ 320.14114 174.2
[M-H]- 280.17070 176.1
[M+Na-2H]- 302.15265 179.9
[M]+ 281.17743 174.2
[M]- 281.17853 174.2
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

patents stripe