CID 98898

2,6-di-tert-butyl-4-methylpyridine

Structural Information

Molecular Formula
C14H23N
SMILES
CC1=CC(=NC(=C1)C(C)(C)C)C(C)(C)C
InChI
InChI=1S/C14H23N/c1-10-8-11(13(2,3)4)15-12(9-10)14(5,6)7/h8-9H,1-7H3
InChIKey
HVHZEKKZMFRULH-UHFFFAOYSA-N
Compound name
2,6-ditert-butyl-4-methylpyridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

6
References

6888
Patents

205.18304 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.19032 149.5
[M+Na]+ 228.17226 157.9
[M-H]- 204.17576 152.4
[M+NH4]+ 223.21686 168.5
[M+K]+ 244.14620 155.7
[M+H-H2O]+ 188.18030 144.1
[M+HCOO]- 250.18124 168.1
[M+CH3COO]- 264.19689 191.0
[M+Na-2H]- 226.15771 155.4
[M]+ 205.18249 151.5
[M]- 205.18359 151.5
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.