CID 208137

1-(2-furyl)-2-(isopropylamino)-1-propanone hydrochloride

Structural Information

Molecular Formula
C10H15NO2
SMILES
CC(C)NC(C)C(=O)C1=CC=CO1
InChI
InChI=1S/C10H15NO2/c1-7(2)11-8(3)10(12)9-5-4-6-13-9/h4-8,11H,1-3H3
InChIKey
NAPLGIIBTAYODB-UHFFFAOYSA-N
Compound name
1-(furan-2-yl)-2-(propan-2-ylamino)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.11028 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.11756 142.9
[M+Na]+ 204.09950 148.4
[M-H]- 180.10300 147.0
[M+NH4]+ 199.14410 162.7
[M+K]+ 220.07344 149.0
[M+H-H2O]+ 164.10754 137.0
[M+HCOO]- 226.10848 165.5
[M+CH3COO]- 240.12413 185.0
[M+Na-2H]- 202.08495 145.7
[M]+ 181.10973 143.9
[M]- 181.11083 143.9
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.