CID 6506666

1-acetylbenzocyclobutene oxime

Structural Information

Molecular Formula
C10H11NO
SMILES
C/C(=N/O)/C1CC2=CC=CC=C12
InChI
InChI=1S/C10H11NO/c1-7(11-12)10-6-8-4-2-3-5-9(8)10/h2-5,10,12H,6H2,1H3/b11-7-
InChIKey
OEECJXXNEJIBMM-XFFZJAGNSA-N
Compound name
(NZ)-N-[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.08406 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.09134 132.9
[M+Na]+ 184.07328 140.5
[M+NH4]+ 179.11788 138.2
[M+K]+ 200.04722 136.1
[M-H]- 160.07678 132.9
[M+Na-2H]- 182.05873 136.7
[M]+ 161.08351 132.7
[M]- 161.08461 132.7
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.