CID 22952996

4,5,6-trimethylpyridin-3-amine

Structural Information

Molecular Formula
C8H12N2
SMILES
CC1=C(C(=CN=C1C)N)C
InChI
InChI=1S/C8H12N2/c1-5-6(2)8(9)4-10-7(5)3/h4H,9H2,1-3H3
InChIKey
NUOBZEUVCGDJNU-UHFFFAOYSA-N
Compound name
4,5,6-trimethylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

136.10005 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 127.6
[M+Na]+ 159.08927 137.6
[M-H]- 135.09277 130.5
[M+NH4]+ 154.13387 148.6
[M+K]+ 175.06321 135.4
[M+H-H2O]+ 119.09731 121.9
[M+HCOO]- 181.09825 151.7
[M+CH3COO]- 195.11390 178.5
[M+Na-2H]- 157.07472 133.6
[M]+ 136.09950 127.1
[M]- 136.10060 127.1
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