CID 135440536

4-(4-hydroxyphenyl)-1-naphthaldehyde oxime

Structural Information

Molecular Formula
C17H13NO2
SMILES
C1=CC=C2C(=C1)C(=CC=C2C3=CC=C(C=C3)O)/C=N/O
InChI
InChI=1S/C17H13NO2/c19-14-8-5-12(6-9-14)16-10-7-13(11-18-20)15-3-1-2-4-17(15)16/h1-11,19-20H/b18-11+
InChIKey
VYQQTWUZKPWPRL-WOJGMQOQSA-N
Compound name
4-[4-[(E)-hydroxyiminomethyl]naphthalen-1-yl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

15
Patents

263.09464 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.10192 157.8
[M+Na]+ 286.08386 166.3
[M-H]- 262.08736 164.6
[M+NH4]+ 281.12846 174.6
[M+K]+ 302.05780 160.7
[M+H-H2O]+ 246.09190 150.1
[M+HCOO]- 308.09284 181.1
[M+CH3COO]- 322.10849 170.1
[M+Na-2H]- 284.06931 165.4
[M]+ 263.09409 157.4
[M]- 263.09519 157.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe