CID 135409273

1-(2-hydroxy-5-methylphenyl)-1-decanone oxime

Structural Information

Molecular Formula
C17H27NO2
SMILES
CCCCCCCCC/C(=N\O)/C1=C(C=CC(=C1)C)O
InChI
InChI=1S/C17H27NO2/c1-3-4-5-6-7-8-9-10-16(18-20)15-13-14(2)11-12-17(15)19/h11-13,19-20H,3-10H2,1-2H3/b18-16+
InChIKey
ZEOXTTGAOFTAKT-FBMGVBCBSA-N
Compound name
2-[(E)-N-hydroxy-C-nonylcarbonimidoyl]-4-methylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.2042 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.21148 170.3
[M+Na]+ 300.19342 174.8
[M-H]- 276.19692 171.7
[M+NH4]+ 295.23802 185.8
[M+K]+ 316.16736 171.0
[M+H-H2O]+ 260.20146 163.2
[M+HCOO]- 322.20240 191.3
[M+CH3COO]- 336.21805 203.4
[M+Na-2H]- 298.17887 171.3
[M]+ 277.20365 172.7
[M]- 277.20475 172.7
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.