CID 3064124

Pan-w-35

Structural Information

Molecular Formula
C10H15N2
SMILES
CC(C)N=CC1=CC=[N+](C=C1)C
InChI
InChI=1S/C10H15N2/c1-9(2)11-8-10-4-6-12(3)7-5-10/h4-9H,1-3H3/q+1
InChIKey
YVYQAQOOUNUQOQ-UHFFFAOYSA-N
Compound name
1-(1-methylpyridin-1-ium-4-yl)-N-propan-2-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.12352 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.13080 135.7
[M+Na]+ 186.11274 143.3
[M-H]- 162.11624 139.8
[M+NH4]+ 181.15734 155.6
[M+K]+ 202.08668 136.5
[M+H-H2O]+ 146.12078 131.7
[M+HCOO]- 208.12172 160.2
[M+CH3COO]- 222.13737 178.1
[M+Na-2H]- 184.09819 144.6
[M]+ 163.12297 135.4
[M]- 163.12407 135.4
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.