CID 3155962

N-(2-aminoethyl)furan-2-carboxamide hydrochloride

Structural Information

Molecular Formula
C7H10N2O2
SMILES
C1=COC(=C1)C(=O)NCCN
InChI
InChI=1S/C7H10N2O2/c8-3-4-9-7(10)6-2-1-5-11-6/h1-2,5H,3-4,8H2,(H,9,10)
InChIKey
QJEGPDSCLYKTNP-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

20
Patents

154.07423 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 131.7
[M+Na]+ 177.063448 138.0
[M-H]- 153.066954 135.4
[M+NH4]+ 172.108053 152.0
[M+K]+ 193.037388 138.0
[M+H-H2O]+ 137.071490 125.5
[M+HCOO]- 199.072431 157.6
[M+CH3COO]- 213.088081 177.8
[M+Na-2H]- 175.048896 137.8
[M]+ 154.07368142 130.9
[M]- 154.07477858 130.9
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