CID 88705

2,3,4,6-tetramethylpyridine

Structural Information

Molecular Formula
C9H13N
SMILES
CC1=CC(=NC(=C1C)C)C
InChI
InChI=1S/C9H13N/c1-6-5-7(2)10-9(4)8(6)3/h5H,1-4H3
InChIKey
QBSVEFGWBSANTE-UHFFFAOYSA-N
Compound name
2,3,4,6-tetramethylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

468
Patents

135.1048 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.112076 126.0
[M+Na]+ 158.094018 136.4
[M-H]- 134.097524 129.3
[M+NH4]+ 153.138623 147.7
[M+K]+ 174.067958 134.6
[M+H-H2O]+ 118.102060 120.6
[M+HCOO]- 180.103001 149.4
[M+CH3COO]- 194.118651 177.4
[M+Na-2H]- 156.079466 132.5
[M]+ 135.10425142 127.7
[M]- 135.10534858 127.7
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