CID 3017881

1-nitroso-2-(3-pyridinyl)-2-pyrrolidinol

Structural Information

Molecular Formula
C9H11N3O2
SMILES
C1CC(N(C1)N=O)(C2=CN=CC=C2)O
InChI
InChI=1S/C9H11N3O2/c13-9(4-2-6-12(9)11-14)8-3-1-5-10-7-8/h1,3,5,7,13H,2,4,6H2
InChIKey
XSFLWWFLOHDYKM-UHFFFAOYSA-N
Compound name
1-nitroso-2-pyridin-3-ylpyrrolidin-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.08513 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09241 138.3
[M+Na]+ 216.07435 146.1
[M-H]- 192.07785 142.6
[M+NH4]+ 211.11895 158.2
[M+K]+ 232.04829 144.4
[M+H-H2O]+ 176.08239 130.5
[M+HCOO]- 238.08333 161.4
[M+CH3COO]- 252.09898 181.7
[M+Na-2H]- 214.05980 145.5
[M]+ 193.08458 136.7
[M]- 193.08568 136.7
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.