CID 135993871

37339-32-5

Structural Information

Molecular Formula
C22H29NO2
SMILES
CCCCCCCCCC1=CC(=C(C=C1)O)/C(=N\O)/C2=CC=CC=C2
InChI
InChI=1S/C22H29NO2/c1-2-3-4-5-6-7-9-12-18-15-16-21(24)20(17-18)22(23-25)19-13-10-8-11-14-19/h8,10-11,13-17,24-25H,2-7,9,12H2,1H3/b23-22-
InChIKey
CROPCLKVTSNPEY-FCQUAONHSA-N
Compound name
2-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]-4-nonylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

339.21982 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.22710 186.2
[M+Na]+ 362.20904 189.8
[M-H]- 338.21254 190.4
[M+NH4]+ 357.25364 198.6
[M+K]+ 378.18298 184.2
[M+H-H2O]+ 322.21708 177.3
[M+HCOO]- 384.21802 207.0
[M+CH3COO]- 398.23367 214.1
[M+Na-2H]- 360.19449 187.2
[M]+ 339.21927 187.7
[M]- 339.22037 187.7
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

patents stripe