CID 9588134

Cyclohexanone, 3-(4-(2-hydroxy-1-methylethyl)phenyl)-, oxime

Structural Information

Molecular Formula
C15H21NO2
SMILES
CC(CO)C1=CC=C(C=C1)C2CCC/C(=N\O)/C2
InChI
InChI=1S/C15H21NO2/c1-11(10-17)12-5-7-13(8-6-12)14-3-2-4-15(9-14)16-18/h5-8,11,14,17-18H,2-4,9-10H2,1H3/b16-15+
InChIKey
YFCJUXUHZGPAGS-FOCLMDBBSA-N
Compound name
2-[4-[(3E)-3-hydroxyiminocyclohexyl]phenyl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.15723 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.164506 158.4
[M+Na]+ 270.146448 162.0
[M-H]- 246.149954 162.8
[M+NH4]+ 265.191053 174.4
[M+K]+ 286.120388 158.6
[M+H-H2O]+ 230.154490 151.1
[M+HCOO]- 292.155431 177.2
[M+CH3COO]- 306.171081 194.2
[M+Na-2H]- 268.131896 160.2
[M]+ 247.15668142 153.2
[M]- 247.15777858 153.2
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.