CID 63564174

1-(oxolan-3-yl)-1-(pyridin-3-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C10H14N2O
SMILES
C1COCC1C(C2=CN=CC=C2)N
InChI
InChI=1S/C10H14N2O/c11-10(9-3-5-13-7-9)8-2-1-4-12-6-8/h1-2,4,6,9-10H,3,5,7,11H2
InChIKey
LYPKOUNPEXXXLQ-UHFFFAOYSA-N
Compound name
oxolan-3-yl(pyridin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.11061 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 138.7
[M+Na]+ 201.09983 143.7
[M-H]- 177.10333 143.6
[M+NH4]+ 196.14443 156.7
[M+K]+ 217.07377 142.8
[M+H-H2O]+ 161.10787 131.1
[M+HCOO]- 223.10881 159.7
[M+CH3COO]- 237.12446 180.2
[M+Na-2H]- 199.08528 143.3
[M]+ 178.11006 134.4
[M]- 178.11116 134.4
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.