CID 5324550

1-(2-thienyl)ethanone oxime

Structural Information

Molecular Formula
C6H7NOS
SMILES
C/C(=N/O)/C1=CC=CS1
InChI
InChI=1S/C6H7NOS/c1-5(7-8)6-3-2-4-9-6/h2-4,8H,1H3/b7-5-
InChIKey
HODHTVIKKXGOCP-ALCCZGGFSA-N
Compound name
(NZ)-N-(1-thiophen-2-ylethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

80
Patents

141.02484 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.03212 128.2
[M+Na]+ 164.01406 138.1
[M+NH4]+ 159.05866 137.4
[M+K]+ 179.98800 132.4
[M-H]- 140.01756 130.2
[M+Na-2H]- 161.99951 133.5
[M]+ 141.02429 130.4
[M]- 141.02539 130.4
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