CID 3060491

78186-45-5

Structural Information

Molecular Formula
C22H31NO
SMILES
CCN(CC)CC(C)C(C1=CC=C(C=C1)C)(C2=CC=C(C=C2)C)O
InChI
InChI=1S/C22H31NO/c1-6-23(7-2)16-19(5)22(24,20-12-8-17(3)9-13-20)21-14-10-18(4)11-15-21/h8-15,19,24H,6-7,16H2,1-5H3
InChIKey
DRJISOXUDPFDGG-UHFFFAOYSA-N
Compound name
3-(diethylamino)-2-methyl-1,1-bis(4-methylphenyl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.24057 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.247846 183.2
[M+Na]+ 348.229788 187.1
[M-H]- 324.233294 189.1
[M+NH4]+ 343.274393 197.0
[M+K]+ 364.203728 183.5
[M+H-H2O]+ 308.237830 175.0
[M+HCOO]- 370.238771 202.4
[M+CH3COO]- 384.254421 217.3
[M+Na-2H]- 346.215236 184.2
[M]+ 325.24002142 184.8
[M]- 325.24111858 184.8
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.