CID 58289

Nsc665678

Structural Information

Molecular Formula
C12H13N3
SMILES
CN(C)C=NC1=CC=CC2=C1C=CN=C2
InChI
InChI=1S/C12H13N3/c1-15(2)9-14-12-5-3-4-10-8-13-7-6-11(10)12/h3-9H,1-2H3
InChIKey
YPZWGHLZEZRUQC-UHFFFAOYSA-N
Compound name
N'-isoquinolin-5-yl-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.11095 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.11823 143.2
[M+Na]+ 222.10017 157.0
[M+NH4]+ 217.14477 152.8
[M+K]+ 238.07411 149.0
[M-H]- 198.10367 148.0
[M+Na-2H]- 220.08562 152.3
[M]+ 199.11040 146.6
[M]- 199.11150 146.6
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.