CID 32982

N,n-dimethyl-2-furanpropylamine

Structural Information

Molecular Formula
C9H15NO
SMILES
CN(C)CCCC1=CC=CO1
InChI
InChI=1S/C9H15NO/c1-10(2)7-3-5-9-6-4-8-11-9/h4,6,8H,3,5,7H2,1-2H3
InChIKey
ZVYXJRBGGKPKDF-UHFFFAOYSA-N
Compound name
3-(furan-2-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

153.11537 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 134.4
[M+Na]+ 176.10459 141.0
[M-H]- 152.10809 139.8
[M+NH4]+ 171.14919 156.3
[M+K]+ 192.07853 142.0
[M+H-H2O]+ 136.11263 128.4
[M+HCOO]- 198.11357 160.4
[M+CH3COO]- 212.12922 181.7
[M+Na-2H]- 174.09004 140.7
[M]+ 153.11482 137.5
[M]- 153.11592 137.5
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