CID 213388

Brn 2147136

Structural Information

Molecular Formula
C22H31NO2
SMILES
CC1=CC=CC=C1OC2=CC=CC=C2OC(C)CN(C(C)C)C(C)C
InChI
InChI=1S/C22H31NO2/c1-16(2)23(17(3)4)15-19(6)24-21-13-9-10-14-22(21)25-20-12-8-7-11-18(20)5/h7-14,16-17,19H,15H2,1-6H3
InChIKey
RYRYZEHIFNUTJM-UHFFFAOYSA-N
Compound name
2-[2-(2-methylphenoxy)phenoxy]-N,N-di(propan-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.23547 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.24275 186.2
[M+Na]+ 364.22469 198.1
[M+NH4]+ 359.26929 193.7
[M+K]+ 380.19863 191.3
[M-H]- 340.22819 191.1
[M+Na-2H]- 362.21014 193.4
[M]+ 341.23492 189.3
[M]- 341.23602 189.3
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.