CID 3017458

Schembl11274926

Structural Information

Molecular Formula
C11H12N2O
SMILES
C1CC(=CC(=NO)C1)C2=CC=NC=C2
InChI
InChI=1S/C11H12N2O/c14-13-11-3-1-2-10(8-11)9-4-6-12-7-5-9/h4-8,14H,1-3H2
InChIKey
XZJNKMZDJMQHQE-UHFFFAOYSA-N
Compound name
N-(3-pyridin-4-ylcyclohex-2-en-1-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

188.09496 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.102236 139.5
[M+Na]+ 211.084178 145.8
[M-H]- 187.087684 144.5
[M+NH4]+ 206.128783 157.2
[M+K]+ 227.058118 142.7
[M+H-H2O]+ 171.092220 131.6
[M+HCOO]- 233.093161 162.2
[M+CH3COO]- 247.108811 182.7
[M+Na-2H]- 209.069626 147.0
[M]+ 188.09441142 135.5
[M]- 188.09550858 135.5
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

patents stripe