CID 71607468

6-chloro-1-methyl-1,2,3,4-tetrahydroquinoxaline

Structural Information

Molecular Formula
C9H11ClN2
SMILES
CN1CCNC2=C1C=CC(=C2)Cl
InChI
InChI=1S/C9H11ClN2/c1-12-5-4-11-8-6-7(10)2-3-9(8)12/h2-3,6,11H,4-5H2,1H3
InChIKey
ABSNBGOYKMLINX-UHFFFAOYSA-N
Compound name
7-chloro-4-methyl-2,3-dihydro-1H-quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.06108 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.06836 136.3
[M+Na]+ 205.05030 151.1
[M+NH4]+ 200.09490 146.0
[M+K]+ 221.02424 143.1
[M-H]- 181.05380 138.4
[M+Na-2H]- 203.03575 143.0
[M]+ 182.06053 139.3
[M]- 182.06163 139.3
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.