CID 21885170

Xrp5gbw7w8

Structural Information

Molecular Formula
C15H17NO
SMILES
CC(C)ON(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C15H17NO/c1-13(2)17-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey
XQPCBFAEXQDCDF-UHFFFAOYSA-N
Compound name
N-phenyl-N-propan-2-yloxyaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

225
Patents

227.13101 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.13829 152.2
[M+Na]+ 250.12023 157.3
[M-H]- 226.12373 159.8
[M+NH4]+ 245.16483 170.1
[M+K]+ 266.09417 155.5
[M+H-H2O]+ 210.12827 144.1
[M+HCOO]- 272.12921 177.0
[M+CH3COO]- 286.14486 196.3
[M+Na-2H]- 248.10568 158.1
[M]+ 227.13046 153.0
[M]- 227.13156 153.0
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.