CID 75356447

1-cyclopropyl-6-fluoro-1,2,3,4-tetrahydroquinoxaline

Structural Information

Molecular Formula
C11H13FN2
SMILES
C1CC1N2CCNC3=C2C=CC(=C3)F
InChI
InChI=1S/C11H13FN2/c12-8-1-4-11-10(7-8)13-5-6-14(11)9-2-3-9/h1,4,7,9,13H,2-3,5-6H2
InChIKey
BWUHTYKQMMZEMF-UHFFFAOYSA-N
Compound name
4-cyclopropyl-7-fluoro-2,3-dihydro-1H-quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.10628 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.11356 145.0
[M+Na]+ 215.09550 154.4
[M-H]- 191.09900 147.5
[M+NH4]+ 210.14010 157.5
[M+K]+ 231.06944 148.9
[M+H-H2O]+ 175.10354 136.0
[M+HCOO]- 237.10448 161.4
[M+CH3COO]- 251.12013 155.9
[M+Na-2H]- 213.08095 150.7
[M]+ 192.10573 141.4
[M]- 192.10683 141.4
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.