CID 25855

13313-82-1

Structural Information

Molecular Formula
C20H33NO
SMILES
CC1CCCCC1(C2=CC=CC=C2C(C)C)OCCN(C)C
InChI
InChI=1S/C20H33NO/c1-16(2)18-11-6-7-12-19(18)20(22-15-14-21(4)5)13-9-8-10-17(20)3/h6-7,11-12,16-17H,8-10,13-15H2,1-5H3
InChIKey
AGSTUROSBNSUDQ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[2-methyl-1-(2-propan-2-ylphenyl)cyclohexyl]oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.25623 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.26351 178.1
[M+Na]+ 326.24545 189.1
[M+NH4]+ 321.29005 188.1
[M+K]+ 342.21939 179.5
[M-H]- 302.24895 183.4
[M+Na-2H]- 324.23090 185.9
[M]+ 303.25568 181.4
[M]- 303.25678 181.4
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.