CID 135478032

50849-47-3

Structural Information

Molecular Formula
C16H25NO2
SMILES
CCCCCCCCCC1=CC(=C(C=C1)O)/C=N/O
InChI
InChI=1S/C16H25NO2/c1-2-3-4-5-6-7-8-9-14-10-11-16(18)15(12-14)13-17-19/h10-13,18-19H,2-9H2,1H3/b17-13+
InChIKey
MJUVQSGLWOGIOB-GHRIWEEISA-N
Compound name
2-[(E)-hydroxyiminomethyl]-4-nonylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

279
Patents

263.18854 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.19582 165.0
[M+Na]+ 286.17776 170.3
[M-H]- 262.18126 166.6
[M+NH4]+ 281.22236 181.2
[M+K]+ 302.15170 166.2
[M+H-H2O]+ 246.18580 158.1
[M+HCOO]- 308.18674 187.4
[M+CH3COO]- 322.20239 199.6
[M+Na-2H]- 284.16321 167.9
[M]+ 263.18799 167.7
[M]- 263.18909 167.7
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.