CID 25219407

2-(azidomethyl)-4-methoxy-3,5-dimethylpyridine

Structural Information

Molecular Formula
C9H12N4O
SMILES
CC1=CN=C(C(=C1OC)C)CN=[N+]=[N-]
InChI
InChI=1S/C9H12N4O/c1-6-4-11-8(5-12-13-10)7(2)9(6)14-3/h4H,5H2,1-3H3
InChIKey
DOIVWEUSKRITNF-UHFFFAOYSA-N
Compound name
2-(azidomethyl)-4-methoxy-3,5-dimethylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.1011 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.10838 139.8
[M+Na]+ 215.09032 148.6
[M-H]- 191.09382 145.6
[M+NH4]+ 210.13492 158.9
[M+K]+ 231.06426 142.8
[M+H-H2O]+ 175.09836 137.0
[M+HCOO]- 237.09930 170.1
[M+CH3COO]- 251.11495 189.5
[M+Na-2H]- 213.07577 149.7
[M]+ 192.10055 140.7
[M]- 192.10165 140.7
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.