CID 212579

2-(2-phenoxyphenoxy)-n,n-di(propan-2-yl)propan-1-amine

Structural Information

Molecular Formula
C21H29NO2
SMILES
CC(C)N(CC(C)OC1=CC=CC=C1OC2=CC=CC=C2)C(C)C
InChI
InChI=1S/C21H29NO2/c1-16(2)22(17(3)4)15-18(5)23-20-13-9-10-14-21(20)24-19-11-7-6-8-12-19/h6-14,16-18H,15H2,1-5H3
InChIKey
FNRXXQGQLCDVKY-UHFFFAOYSA-N
Compound name
2-(2-phenoxyphenoxy)-N,N-di(propan-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.21982 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.227096 183.3
[M+Na]+ 350.209038 186.0
[M-H]- 326.212544 190.2
[M+NH4]+ 345.253643 197.1
[M+K]+ 366.182978 184.6
[M+H-H2O]+ 310.217080 174.2
[M+HCOO]- 372.218021 204.2
[M+CH3COO]- 386.233671 219.0
[M+Na-2H]- 348.194486 182.8
[M]+ 327.21927142 186.7
[M]- 327.22036858 186.7
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.