CID 6288025

Dtxsid50429606

Structural Information

Molecular Formula
C11H13N3O2
SMILES
C1CC(OC1)C(=O)N/N=C\C2=CC=CC=N2
InChI
InChI=1S/C11H13N3O2/c15-11(10-5-3-7-16-10)14-13-8-9-4-1-2-6-12-9/h1-2,4,6,8,10H,3,5,7H2,(H,14,15)/b13-8-
InChIKey
LRHMZHDBTCGIPJ-JYRVWZFOSA-N
Compound name
N-[(Z)-pyridin-2-ylmethylideneamino]oxolane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.10077 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.108046 147.5
[M+Na]+ 242.089988 152.2
[M-H]- 218.093494 154.2
[M+NH4]+ 237.134593 164.3
[M+K]+ 258.063928 151.6
[M+H-H2O]+ 202.098030 139.0
[M+HCOO]- 264.098971 171.9
[M+CH3COO]- 278.114621 190.6
[M+Na-2H]- 240.075436 153.6
[M]+ 219.10022142 145.6
[M]- 219.10131858 145.6
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.