CID 62489808

2-cyclopropyl-4-fluoroaniline

Structural Information

Molecular Formula
C9H10FN
SMILES
C1CC1C2=C(C=CC(=C2)F)N
InChI
InChI=1S/C9H10FN/c10-7-3-4-9(11)8(5-7)6-1-2-6/h3-6H,1-2,11H2
InChIKey
VYZFBDMDLZPLCQ-UHFFFAOYSA-N
Compound name
2-cyclopropyl-4-fluoroaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

151.07973 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.087006 124.2
[M+Na]+ 174.068948 134.6
[M-H]- 150.072454 130.7
[M+NH4]+ 169.113553 140.5
[M+K]+ 190.042888 131.0
[M+H-H2O]+ 134.076990 117.3
[M+HCOO]- 196.077931 148.8
[M+CH3COO]- 210.093581 182.3
[M+Na-2H]- 172.054396 130.7
[M]+ 151.07918142 123.4
[M]- 151.08027858 123.4
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