CID 3041915

58774-92-8

Structural Information

Molecular Formula
C14H21NO
SMILES
CCN(CC)C1C2=CC=CC=C2OC1(C)C
InChI
InChI=1S/C14H21NO/c1-5-15(6-2)13-11-9-7-8-10-12(11)16-14(13,3)4/h7-10,13H,5-6H2,1-4H3
InChIKey
QDYUJBUGHVBRJW-UHFFFAOYSA-N
Compound name
N,N-diethyl-2,2-dimethyl-3H-1-benzofuran-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.16231 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.16959 151.0
[M+Na]+ 242.15153 158.8
[M-H]- 218.15503 157.6
[M+NH4]+ 237.19613 173.9
[M+K]+ 258.12547 158.1
[M+H-H2O]+ 202.15957 145.6
[M+HCOO]- 264.16051 173.9
[M+CH3COO]- 278.17616 196.2
[M+Na-2H]- 240.13698 156.5
[M]+ 219.16176 154.4
[M]- 219.16286 154.4
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

No patent data available for this compound.