CID 13591222

Cor 2843

Structural Information

Molecular Formula
C23H32N2O2
SMILES
CC1=CC=CC=C1N2CCN(CC2)CCOC3=C(C=C(C(=C3)C)O)C(C)C
InChI
InChI=1S/C23H32N2O2/c1-17(2)20-16-22(26)19(4)15-23(20)27-14-13-24-9-11-25(12-10-24)21-8-6-5-7-18(21)3/h5-8,15-17,26H,9-14H2,1-4H3
InChIKey
WTNFUCMGDQCPLN-UHFFFAOYSA-N
Compound name
2-methyl-4-[2-[4-(2-methylphenyl)piperazin-1-yl]ethoxy]-5-propan-2-ylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

368.24637 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.25365 194.6
[M+Na]+ 391.23559 199.1
[M-H]- 367.23909 199.3
[M+NH4]+ 386.28019 203.4
[M+K]+ 407.20953 193.6
[M+H-H2O]+ 351.24363 183.6
[M+HCOO]- 413.24457 207.9
[M+CH3COO]- 427.26022 219.4
[M+Na-2H]- 389.22104 192.0
[M]+ 368.24582 193.1
[M]- 368.24692 193.1
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.