CID 2776360

(4-benzylmorpholin-2-yl)methanamine

Structural Information

Molecular Formula
C12H18N2O
SMILES
C1COC(CN1CC2=CC=CC=C2)CN
InChI
InChI=1S/C12H18N2O/c13-8-12-10-14(6-7-15-12)9-11-4-2-1-3-5-11/h1-5,12H,6-10,13H2
InChIKey
CKZVBXBEDDAEFE-UHFFFAOYSA-N
Compound name
(4-benzylmorpholin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

346
Patents

206.1419 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.14918 147.8
[M+Na]+ 229.13112 152.4
[M-H]- 205.13462 152.3
[M+NH4]+ 224.17572 163.2
[M+K]+ 245.10506 150.5
[M+H-H2O]+ 189.13916 139.5
[M+HCOO]- 251.14010 167.0
[M+CH3COO]- 265.15575 187.0
[M+Na-2H]- 227.11657 153.4
[M]+ 206.14135 143.1
[M]- 206.14245 143.1
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