CID 16780862

8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline

Structural Information

Molecular Formula
C10H11F2NO
SMILES
C1CC2=C(C(=CC=C2)OC(F)F)NC1
InChI
InChI=1S/C10H11F2NO/c11-10(12)14-8-5-1-3-7-4-2-6-13-9(7)8/h1,3,5,10,13H,2,4,6H2
InChIKey
HJNVCPDINIURFY-UHFFFAOYSA-N
Compound name
8-(difluoromethoxy)-1,2,3,4-tetrahydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

199.08087 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08815 142.0
[M+Na]+ 222.07009 152.3
[M+NH4]+ 217.11469 149.4
[M+K]+ 238.04403 146.2
[M-H]- 198.07359 140.9
[M+Na-2H]- 220.05554 146.3
[M]+ 199.08032 142.8
[M]- 199.08142 142.8
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

patents stripe