CID 9604752

(4-methoxyphenyl)-(3-methylbenzofuran-2-yl)methanone oxime

Structural Information

Molecular Formula
C17H15NO3
SMILES
CC1=C(OC2=CC=CC=C12)/C(=N\O)/C3=CC=C(C=C3)OC
InChI
InChI=1S/C17H15NO3/c1-11-14-5-3-4-6-15(14)21-17(11)16(18-19)12-7-9-13(20-2)10-8-12/h3-10,19H,1-2H3/b18-16-
InChIKey
NYQFMGIQOXOIQI-VLGSPTGOSA-N
Compound name
(NZ)-N-[(4-methoxyphenyl)-(3-methyl-1-benzofuran-2-yl)methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

281.1052 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.11248 163.1
[M+Na]+ 304.09442 172.6
[M-H]- 280.09792 172.6
[M+NH4]+ 299.13902 180.5
[M+K]+ 320.06836 170.0
[M+H-H2O]+ 264.10246 156.0
[M+HCOO]- 326.10340 188.4
[M+CH3COO]- 340.11905 202.3
[M+Na-2H]- 302.07987 168.9
[M]+ 281.10465 168.3
[M]- 281.10575 168.3
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

No patent data available for this compound.