CID 18577

3215-84-7

Structural Information

Molecular Formula
C23H31NO3
SMILES
CC(C)(CCC(=O)C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)N(C)C
InChI
InChI=1S/C23H31NO3/c1-23(2,16-15-21(25)17-7-11-19(26-5)12-8-17)22(24(3)4)18-9-13-20(27-6)14-10-18/h7-14,22H,15-16H2,1-6H3
InChIKey
CUVQLAOFVFKROR-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-1,5-bis(4-methoxyphenyl)-4,4-dimethylpentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.2304 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.23768 191.9
[M+Na]+ 392.21962 203.2
[M+NH4]+ 387.26422 198.3
[M+K]+ 408.19356 197.1
[M-H]- 368.22312 195.6
[M+Na-2H]- 390.20507 198.7
[M]+ 369.22985 194.6
[M]- 369.23095 194.6
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

No patent data available for this compound.