CID 33041

25537-69-3

Structural Information

Molecular Formula
C15H19NO
SMILES
CN(C)C(CCC1=CC=CO1)C2=CC=CC=C2
InChI
InChI=1S/C15H19NO/c1-16(2)15(13-7-4-3-5-8-13)11-10-14-9-6-12-17-14/h3-9,12,15H,10-11H2,1-2H3
InChIKey
MVDJONFBOONCRN-UHFFFAOYSA-N
Compound name
3-(furan-2-yl)-N,N-dimethyl-1-phenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.14667 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.153946 155.4
[M+Na]+ 252.135888 160.5
[M-H]- 228.139394 163.6
[M+NH4]+ 247.180493 173.8
[M+K]+ 268.109828 159.8
[M+H-H2O]+ 212.143930 147.9
[M+HCOO]- 274.144871 180.0
[M+CH3COO]- 288.160521 196.1
[M+Na-2H]- 250.121336 159.5
[M]+ 229.14612142 157.5
[M]- 229.14721858 157.5
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.