CID 24709506

[1-(1-benzofuran-2-yl)ethyl](ethyl)amine

Structural Information

Molecular Formula
C12H15NO
SMILES
CCNC(C)C1=CC2=CC=CC=C2O1
InChI
InChI=1S/C12H15NO/c1-3-13-9(2)12-8-10-6-4-5-7-11(10)14-12/h4-9,13H,3H2,1-2H3
InChIKey
XLCDXJDKWGOIPA-UHFFFAOYSA-N
Compound name
1-(1-benzofuran-2-yl)-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.11537 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.12265 140.9
[M+Na]+ 212.10459 149.4
[M-H]- 188.10809 146.6
[M+NH4]+ 207.14919 162.2
[M+K]+ 228.07853 147.7
[M+H-H2O]+ 172.11263 135.2
[M+HCOO]- 234.11357 166.0
[M+CH3COO]- 248.12922 186.3
[M+Na-2H]- 210.09004 148.5
[M]+ 189.11482 144.0
[M]- 189.11592 144.0
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

No patent data available for this compound.