CID 138265

2-butoxyaniline

Structural Information

Molecular Formula
C10H15NO
SMILES
CCCCOC1=CC=CC=C1N
InChI
InChI=1S/C10H15NO/c1-2-3-8-12-10-7-5-4-6-9(10)11/h4-7H,2-3,8,11H2,1H3
InChIKey
IRTONKUCLPTRNS-UHFFFAOYSA-N
Compound name
2-butoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

292
Patents

165.11537 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 135.8
[M+Na]+ 188.10459 148.0
[M+NH4]+ 183.14919 144.7
[M+K]+ 204.07853 141.0
[M-H]- 164.10809 138.9
[M+Na-2H]- 186.09004 143.0
[M]+ 165.11482 138.4
[M]- 165.11592 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

literature stripe

Patent stripe

patents stripe