CID 72232484

1-(2-cyclopropoxy-4-fluorophenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C10H12FNO
SMILES
C1CC1OC2=C(C=CC(=C2)F)CN
InChI
InChI=1S/C10H12FNO/c11-8-2-1-7(6-12)10(5-8)13-9-3-4-9/h1-2,5,9H,3-4,6,12H2
InChIKey
MIEXLRSSFJSKQW-UHFFFAOYSA-N
Compound name
(2-cyclopropyloxy-4-fluorophenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

181.09029 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.09757 132.4
[M+Na]+ 204.07951 142.3
[M-H]- 180.08301 138.7
[M+NH4]+ 199.12411 147.5
[M+K]+ 220.05345 138.8
[M+H-H2O]+ 164.08755 125.1
[M+HCOO]- 226.08849 156.9
[M+CH3COO]- 240.10414 187.1
[M+Na-2H]- 202.06496 138.3
[M]+ 181.08974 133.4
[M]- 181.09084 133.4
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