CID 15022

1425-59-8

Structural Information

Molecular Formula
C15H20N2O
SMILES
CC(CCN1CCOCC1)(C#N)C2=CC=CC=C2
InChI
InChI=1S/C15H20N2O/c1-15(13-16,14-5-3-2-4-6-14)7-8-17-9-11-18-12-10-17/h2-6H,7-12H2,1H3
InChIKey
QOBDYSKUZHDWOI-UHFFFAOYSA-N
Compound name
2-methyl-4-morpholin-4-yl-2-phenylbutanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.15756 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.16484 163.1
[M+Na]+ 267.14678 174.5
[M+NH4]+ 262.19138 167.6
[M+K]+ 283.12072 164.5
[M-H]- 243.15028 159.8
[M+Na-2H]- 265.13223 167.0
[M]+ 244.15701 163.0
[M]- 244.15811 163.0
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.