CID 24844567

Pyridine, 3-methyl-2-amino-n-(2-oxazolin-2-yl)-, hydrochloride

Structural Information

Molecular Formula
C9H13N3O
SMILES
CC1=C(N(CC=C1)C2=NCCO2)N
InChI
InChI=1S/C9H13N3O/c1-7-3-2-5-12(8(7)10)9-11-4-6-13-9/h2-3H,4-6,10H2,1H3
InChIKey
UGVOSCNGQFRBPP-UHFFFAOYSA-N
Compound name
1-(4,5-dihydro-1,3-oxazol-2-yl)-5-methyl-2H-pyridin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.10587 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.113146 138.7
[M+Na]+ 202.095088 146.6
[M-H]- 178.098594 143.1
[M+NH4]+ 197.139693 156.1
[M+K]+ 218.069028 145.2
[M+H-H2O]+ 162.103130 130.8
[M+HCOO]- 224.104071 159.7
[M+CH3COO]- 238.119721 151.6
[M+Na-2H]- 200.080536 143.4
[M]+ 179.10532142 136.0
[M]- 179.10641858 136.0
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.