CID 178244266

N-[1-(1-oxothiophen-2-yl)ethylidene]hydroxylamine

Structural Information

Molecular Formula
C6H7NO2S
SMILES
CC(=NO)C1=CC=CS1=O
InChI
InChI=1S/C6H7NO2S/c1-5(7-8)6-3-2-4-10(6)9/h2-4,8H,1H3
InChIKey
QIXSRCOFRHVPQU-UHFFFAOYSA-N
Compound name
N-[1-(1-oxothiophen-2-yl)ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.01974 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.027016 129.6
[M+Na]+ 180.008958 138.8
[M-H]- 156.012464 134.2
[M+NH4]+ 175.053563 152.8
[M+K]+ 195.982898 137.0
[M+H-H2O]+ 140.017000 124.5
[M+HCOO]- 202.017941 151.3
[M+CH3COO]- 216.033591 174.6
[M+Na-2H]- 177.994406 132.2
[M]+ 157.01919142 131.8
[M]- 157.02028858 131.8
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.