CID 14313946

N-formylloline

Structural Information

Molecular Formula
C9H14N2O2
SMILES
CN(C=O)[C@H]1[C@H]2CN3[C@@H]1[C@@H](O2)CC3
InChI
InChI=1S/C9H14N2O2/c1-10(5-12)8-7-4-11-3-2-6(13-7)9(8)11/h5-9H,2-4H2,1H3/t6-,7+,8-,9+/m0/s1
InChIKey
YHLKXYXFUCTURZ-UYXSQOIJSA-N
Compound name
N-methyl-N-[(1R,3S,7S,8R)-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-yl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

87
Patents

182.10553 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.11281 137.8
[M+Na]+ 205.09475 144.8
[M+NH4]+ 200.13935 146.9
[M+K]+ 221.06869 146.2
[M-H]- 181.09825 138.6
[M+Na-2H]- 203.08020 136.4
[M]+ 182.10498 138.6
[M]- 182.10608 138.6
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

patents stripe