CID 217450

38914-87-3

Structural Information

Molecular Formula
C11H20NO
SMILES
CC[N+](C)(C)CCC1=CC=C(O1)C
InChI
InChI=1S/C11H20NO/c1-5-12(3,4)9-8-11-7-6-10(2)13-11/h6-7H,5,8-9H2,1-4H3/q+1
InChIKey
GKMLSOUPMRXHSV-UHFFFAOYSA-N
Compound name
ethyl-dimethyl-[2-(5-methylfuran-2-yl)ethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.1545 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.16178 139.6
[M+Na]+ 205.14372 152.7
[M+NH4]+ 200.18832 149.6
[M+K]+ 221.11766 149.1
[M-H]- 181.14722 145.0
[M+Na-2H]- 203.12917 146.3
[M]+ 182.15395 143.5
[M]- 182.15505 143.5
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.