CID 93788

57751-98-1

Structural Information

Molecular Formula
C21H24N2O
SMILES
CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CO3
InChI
InChI=1S/C21H24N2O/c1-22(2)18-11-7-16(8-12-18)21(20-6-5-15-24-20)17-9-13-19(14-10-17)23(3)4/h5-15,21H,1-4H3
InChIKey
RFNXXUAWWBQHAZ-UHFFFAOYSA-N
Compound name
4-[[4-(dimethylamino)phenyl]-(furan-2-yl)methyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

320.18887 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.19615 180.6
[M+Na]+ 343.17809 185.5
[M-H]- 319.18159 193.6
[M+NH4]+ 338.22269 195.5
[M+K]+ 359.15203 184.2
[M+H-H2O]+ 303.18613 171.2
[M+HCOO]- 365.18707 206.0
[M+CH3COO]- 379.20272 220.4
[M+Na-2H]- 341.16354 182.0
[M]+ 320.18832 183.6
[M]- 320.18942 183.6
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