CID 188075

68743-67-9

Structural Information

Molecular Formula
C9H11N3O2
SMILES
C1CC(N(C1C2=CN=CC=C2)N=O)O
InChI
InChI=1S/C9H11N3O2/c13-9-4-3-8(12(9)11-14)7-2-1-5-10-6-7/h1-2,5-6,8-9,13H,3-4H2
InChIKey
OPIMKKJZZFWGRJ-UHFFFAOYSA-N
Compound name
1-nitroso-5-pyridin-3-ylpyrrolidin-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.08513 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09241 139.0
[M+Na]+ 216.07435 146.8
[M-H]- 192.07785 143.3
[M+NH4]+ 211.11895 157.2
[M+K]+ 232.04829 144.8
[M+H-H2O]+ 176.08239 130.8
[M+HCOO]- 238.08333 162.0
[M+CH3COO]- 252.09898 183.3
[M+Na-2H]- 214.05980 144.3
[M]+ 193.08458 137.5
[M]- 193.08568 137.5
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

No patent data available for this compound.