CID 1080489

N-(furan-2-ylmethyl)cyclopentanamine

Structural Information

Molecular Formula
C10H15NO
SMILES
C1CCC(C1)NCC2=CC=CO2
InChI
InChI=1S/C10H15NO/c1-2-5-9(4-1)11-8-10-6-3-7-12-10/h3,6-7,9,11H,1-2,4-5,8H2
InChIKey
QTSNVDAUJAGULA-UHFFFAOYSA-N
Compound name
N-(furan-2-ylmethyl)cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

165.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.122646 135.8
[M+Na]+ 188.104588 140.9
[M-H]- 164.108094 142.5
[M+NH4]+ 183.149193 157.8
[M+K]+ 204.078528 140.4
[M+H-H2O]+ 148.112630 129.8
[M+HCOO]- 210.113571 160.4
[M+CH3COO]- 224.129221 177.9
[M+Na-2H]- 186.090036 140.4
[M]+ 165.11482142 133.4
[M]- 165.11591858 133.4
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