CID 90019774

1383809-95-7

Structural Information

Molecular Formula
C12H16FN
SMILES
CC1CC(C2=C(C=CC(=C12)N)F)(C)C
InChI
InChI=1S/C12H16FN/c1-7-6-12(2,3)11-8(13)4-5-9(14)10(7)11/h4-5,7H,6,14H2,1-3H3
InChIKey
USXBDIZEJAVICB-UHFFFAOYSA-N
Compound name
7-fluoro-1,1,3-trimethyl-2,3-dihydroinden-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

193.12668 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.13396 140.3
[M+Na]+ 216.11590 150.9
[M-H]- 192.11940 144.1
[M+NH4]+ 211.16050 165.3
[M+K]+ 232.08984 146.9
[M+H-H2O]+ 176.12394 135.2
[M+HCOO]- 238.12488 162.5
[M+CH3COO]- 252.14053 189.1
[M+Na-2H]- 214.10135 143.9
[M]+ 193.12613 138.4
[M]- 193.12723 138.4
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

patents stripe