CID 135441937

Benzaldehyde, 5-dodecyl-2-hydroxy-, oxime

Structural Information

Molecular Formula
C19H31NO2
SMILES
CCCCCCCCCCCCC1=CC(=C(C=C1)O)/C=N/O
InChI
InChI=1S/C19H31NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-14-19(21)18(15-17)16-20-22/h13-16,21-22H,2-12H2,1H3/b20-16+
InChIKey
UWGTVLYQSJNUFP-CAPFRKAQSA-N
Compound name
4-dodecyl-2-[(E)-hydroxyiminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

227
Patents

305.23547 Da
Monoisotopic Mass

7.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.242746 178.5
[M+Na]+ 328.224688 182.4
[M-H]- 304.228194 179.4
[M+NH4]+ 323.269293 192.9
[M+K]+ 344.198628 177.6
[M+H-H2O]+ 288.232730 170.9
[M+HCOO]- 350.233671 199.8
[M+CH3COO]- 364.249321 208.6
[M+Na-2H]- 326.210136 179.7
[M]+ 305.23492142 182.2
[M]- 305.23601858 182.2
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

patents stripe