CID 961528

97266-25-6

Structural Information

Molecular Formula
C10H16N2
SMILES
CC(C)(C)NCC1=CN=CC=C1
InChI
InChI=1S/C10H16N2/c1-10(2,3)12-8-9-5-4-6-11-7-9/h4-7,12H,8H2,1-3H3
InChIKey
QSDPAWDWCPJGAE-UHFFFAOYSA-N
Compound name
2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

181
Patents

164.13135 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.13863 137.6
[M+Na]+ 187.12057 144.4
[M-H]- 163.12407 139.8
[M+NH4]+ 182.16517 157.0
[M+K]+ 203.09451 142.5
[M+H-H2O]+ 147.12861 131.3
[M+HCOO]- 209.12955 160.1
[M+CH3COO]- 223.14520 181.5
[M+Na-2H]- 185.10602 146.4
[M]+ 164.13080 137.2
[M]- 164.13190 137.2
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

patents stripe