CID 3063890

Morpholine, 4-((1-phenylcyclopentyl)methyl)-

Structural Information

Molecular Formula
C16H23NO
SMILES
C1CCC(C1)(CN2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C16H23NO/c1-2-6-15(7-3-1)16(8-4-5-9-16)14-17-10-12-18-13-11-17/h1-3,6-7H,4-5,8-14H2
InChIKey
QOXZXLACXKHLIF-UHFFFAOYSA-N
Compound name
4-[(1-phenylcyclopentyl)methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.17796 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.185236 159.1
[M+Na]+ 268.167178 162.0
[M-H]- 244.170684 166.3
[M+NH4]+ 263.211783 176.3
[M+K]+ 284.141118 159.8
[M+H-H2O]+ 228.175220 150.3
[M+HCOO]- 290.176161 175.8
[M+CH3COO]- 304.191811 169.5
[M+Na-2H]- 266.152626 162.1
[M]+ 245.17741142 152.5
[M]- 245.17850858 152.5
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.