CID 2795501

[4-(morpholin-4-ylmethyl)phenyl]methanamine

Structural Information

Molecular Formula
C12H18N2O
SMILES
C1COCCN1CC2=CC=C(C=C2)CN
InChI
InChI=1S/C12H18N2O/c13-9-11-1-3-12(4-2-11)10-14-5-7-15-8-6-14/h1-4H,5-10,13H2
InChIKey
OTMQHFNPBREFIL-UHFFFAOYSA-N
Compound name
[4-(morpholin-4-ylmethyl)phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

203
Patents

206.1419 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.149176 147.8
[M+Na]+ 229.131118 152.4
[M-H]- 205.134624 152.3
[M+NH4]+ 224.175723 163.2
[M+K]+ 245.105058 150.5
[M+H-H2O]+ 189.139160 139.5
[M+HCOO]- 251.140101 167.0
[M+CH3COO]- 265.155751 187.0
[M+Na-2H]- 227.116566 153.4
[M]+ 206.14135142 143.1
[M]- 206.14244858 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

No literature data available for this compound.

Patent stripe

patents stripe