CID 97275

2-thiophenecarbaldehyde oxime

Structural Information

Molecular Formula
C5H5NOS
SMILES
C1=CSC(=C1)C=NO
InChI
InChI=1S/C5H5NOS/c7-6-4-5-2-1-3-8-5/h1-4,7H
InChIKey
GASLBPLHYRZLLT-UHFFFAOYSA-N
Compound name
N-(thiophen-2-ylmethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

169
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 121.9
[M+Na]+ 149.99840 130.9
[M-H]- 126.00191 126.3
[M+NH4]+ 145.04301 146.2
[M+K]+ 165.97234 129.1
[M+H-H2O]+ 110.00645 116.8
[M+HCOO]- 172.00739 144.6
[M+CH3COO]- 186.02304 168.5
[M+Na-2H]- 147.98385 126.7
[M]+ 127.00864 123.2
[M]- 127.00973 123.2
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.