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]+ 193.108376 139.8
[M+Na]+ 215.090318 148.6
[M-H]- 191.093824 145.6
[M+NH4]+ 210.134923 158.9
[M+K]+ 231.064258 142.8
[M+H-H2O]+ 175.098360 137.0
[M+HCOO]- 237.099301 170.1
[M+CH3COO]- 251.114951 189.5
[M+Na-2H]- 213.075766 149.7
[M]+ 192.10055142 140.7
[M]- 192.10164858 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.