CID 10727503

N-[1-(5-phenylthiophen-2-yl)ethylidene]hydroxylamine

Structural Information

Molecular Formula
C12H11NOS
SMILES
C/C(=N\O)/C1=CC=C(S1)C2=CC=CC=C2
InChI
InChI=1S/C12H11NOS/c1-9(13-14)11-7-8-12(15-11)10-5-3-2-4-6-10/h2-8,14H,1H3/b13-9+
InChIKey
HVGHVIACTNKFLO-UKTHLTGXSA-N
Compound name
(NE)-N-[1-(5-phenylthiophen-2-yl)ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.05614 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.06342 147.1
[M+Na]+ 240.04536 155.2
[M-H]- 216.04886 154.5
[M+NH4]+ 235.08996 167.7
[M+K]+ 256.01930 151.4
[M+H-H2O]+ 200.05340 140.7
[M+HCOO]- 262.05434 168.3
[M+CH3COO]- 276.06999 187.0
[M+Na-2H]- 238.03081 149.2
[M]+ 217.05559 148.4
[M]- 217.05669 148.4
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.