CID 59037

2-(1-morpholinomethyl)-4-(p-methylphenyl)furan hydrochloride

Structural Information

Molecular Formula
C16H19NO2
SMILES
CC1=CC=C(C=C1)C2=COC(=C2)CN3CCOCC3
InChI
InChI=1S/C16H19NO2/c1-13-2-4-14(5-3-13)15-10-16(19-12-15)11-17-6-8-18-9-7-17/h2-5,10,12H,6-9,11H2,1H3
InChIKey
QEEMOQJKSNDAHZ-UHFFFAOYSA-N
Compound name
4-[[4-(4-methylphenyl)furan-2-yl]methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.14157 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.148846 159.5
[M+Na]+ 280.130788 165.5
[M-H]- 256.134294 168.6
[M+NH4]+ 275.175393 173.7
[M+K]+ 296.104728 164.1
[M+H-H2O]+ 240.138830 151.2
[M+HCOO]- 302.139771 178.3
[M+CH3COO]- 316.155421 171.3
[M+Na-2H]- 278.116236 162.9
[M]+ 257.14102142 158.5
[M]- 257.14211858 158.5
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.