CID 212579

24588-90-7

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]+ 328.22710 183.3
[M+Na]+ 350.20904 186.0
[M-H]- 326.21254 190.2
[M+NH4]+ 345.25364 197.1
[M+K]+ 366.18298 184.6
[M+H-H2O]+ 310.21708 174.2
[M+HCOO]- 372.21802 204.2
[M+CH3COO]- 386.23367 219.0
[M+Na-2H]- 348.19449 182.8
[M]+ 327.21927 186.7
[M]- 327.22037 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.