CID 19908555

1-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-1-amine

Structural Information

Molecular Formula
C11H12F3N
SMILES
C1CC2=CC=CC=C2C(C1)(C(F)(F)F)N
InChI
InChI=1S/C11H12F3N/c12-11(13,14)10(15)7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6H,3,5,7,15H2
InChIKey
JMRLPVTXGZFDSA-UHFFFAOYSA-N
Compound name
1-(trifluoromethyl)-3,4-dihydro-2H-naphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

215.09218 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.099456 144.1
[M+Na]+ 238.081398 152.0
[M-H]- 214.084904 144.1
[M+NH4]+ 233.126003 165.3
[M+K]+ 254.055338 148.0
[M+H-H2O]+ 198.089440 136.3
[M+HCOO]- 260.090381 160.7
[M+CH3COO]- 274.106031 188.2
[M+Na-2H]- 236.066846 150.9
[M]+ 215.09163142 135.6
[M]- 215.09272858 135.6
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

patents stripe