CID 5371572

Thiophene-2-carbaldehyde oxime

Structural Information

Molecular Formula
C5H5NOS
SMILES
C1=CSC(=C1)/C=N\O
InChI
InChI=1S/C5H5NOS/c7-6-4-5-2-1-3-8-5/h1-4,7H/b6-4-
InChIKey
GASLBPLHYRZLLT-XQRVVYSFSA-N
Compound name
(NZ)-N-(thiophen-2-ylmethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

47
Patents

127.009186 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.01646 123.5
[M+Na]+ 149.99840 133.9
[M+NH4]+ 145.04301 133.0
[M+K]+ 165.97234 127.7
[M-H]- 126.00191 125.8
[M+Na-2H]- 147.98385 129.4
[M]+ 127.00864 125.9
[M]- 127.00973 125.9
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