CID 125510

2-benzylmorpholine

Structural Information

Molecular Formula
C11H15NO
SMILES
C1COC(CN1)CC2=CC=CC=C2
InChI
InChI=1S/C11H15NO/c1-2-4-10(5-3-1)8-11-9-12-6-7-13-11/h1-5,11-12H,6-9H2
InChIKey
YZFCMGWCEXUGFX-UHFFFAOYSA-N
Compound name
2-benzylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

381
Patents

177.11537 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 138.9
[M+Na]+ 200.10459 143.4
[M-H]- 176.10809 142.4
[M+NH4]+ 195.14919 155.0
[M+K]+ 216.07853 141.3
[M+H-H2O]+ 160.11263 131.3
[M+HCOO]- 222.11357 156.5
[M+CH3COO]- 236.12922 150.4
[M+Na-2H]- 198.09004 146.0
[M]+ 177.11482 133.3
[M]- 177.11592 133.3
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