CID 6435418

83256-17-1

Structural Information

Molecular Formula
C9H13N3
SMILES
CC1=CC(=NC=N1)/C=C/N(C)C
InChI
InChI=1S/C9H13N3/c1-8-6-9(11-7-10-8)4-5-12(2)3/h4-7H,1-3H3/b5-4+
InChIKey
RJQDPWFZFYTWJS-SNAWJCMRSA-N
Compound name
(E)-N,N-dimethyl-2-(6-methylpyrimidin-4-yl)ethenamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.11095 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.11823 135.6
[M+Na]+ 186.10017 143.8
[M-H]- 162.10367 138.0
[M+NH4]+ 181.14477 154.3
[M+K]+ 202.07411 142.3
[M+H-H2O]+ 146.10821 127.9
[M+HCOO]- 208.10915 159.3
[M+CH3COO]- 222.12480 184.6
[M+Na-2H]- 184.08562 142.9
[M]+ 163.11040 136.7
[M]- 163.11150 136.7
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.