CID 490550

Phenol, 4-[4-[(1-methylethyl)amino]phenoxy]-

Structural Information

Molecular Formula
C15H17NO2
SMILES
CC(C)NC1=CC=C(C=C1)OC2=CC=C(C=C2)O
InChI
InChI=1S/C15H17NO2/c1-11(2)16-12-3-7-14(8-4-12)18-15-9-5-13(17)6-10-15/h3-11,16-17H,1-2H3
InChIKey
VTNOQHCNCWVWKS-UHFFFAOYSA-N
Compound name
4-[4-(propan-2-ylamino)phenoxy]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

243.12593 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.13321 155.2
[M+Na]+ 266.11515 161.6
[M-H]- 242.11865 160.8
[M+NH4]+ 261.15975 171.7
[M+K]+ 282.08909 158.2
[M+H-H2O]+ 226.12319 147.8
[M+HCOO]- 288.12413 178.3
[M+CH3COO]- 302.13978 194.6
[M+Na-2H]- 264.10060 160.0
[M]+ 243.12538 155.1
[M]- 243.12648 155.1
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.