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]+ 246.18524 159.1
[M+Na]+ 268.16718 162.0
[M-H]- 244.17068 166.3
[M+NH4]+ 263.21178 176.3
[M+K]+ 284.14112 159.8
[M+H-H2O]+ 228.17522 150.3
[M+HCOO]- 290.17616 175.8
[M+CH3COO]- 304.19181 169.5
[M+Na-2H]- 266.15263 162.1
[M]+ 245.17741 152.5
[M]- 245.17851 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.