CID 24262371

{4-[(4-methylphenyl)methyl]morpholin-2-yl}methanamine

Structural Information

Molecular Formula
C13H20N2O
SMILES
CC1=CC=C(C=C1)CN2CCOC(C2)CN
InChI
InChI=1S/C13H20N2O/c1-11-2-4-12(5-3-11)9-15-6-7-16-13(8-14)10-15/h2-5,13H,6-10,14H2,1H3
InChIKey
XYEYAYNRWWUWDU-UHFFFAOYSA-N
Compound name
[4-[(4-methylphenyl)methyl]morpholin-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.15756 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.16484 152.9
[M+Na]+ 243.14678 158.0
[M-H]- 219.15028 157.6
[M+NH4]+ 238.19138 168.0
[M+K]+ 259.12072 155.8
[M+H-H2O]+ 203.15482 144.6
[M+HCOO]- 265.15576 171.7
[M+CH3COO]- 279.17141 191.2
[M+Na-2H]- 241.13223 157.1
[M]+ 220.15701 148.9
[M]- 220.15811 148.9
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