CID 3155706

725226-25-5

Structural Information

Molecular Formula
C13H19NO2
SMILES
COC1=CC=CC=C1CNCC2CCCO2
InChI
InChI=1S/C13H19NO2/c1-15-13-7-3-2-5-11(13)9-14-10-12-6-4-8-16-12/h2-3,5,7,12,14H,4,6,8-10H2,1H3
InChIKey
UTJJRYCDUQTLRM-UHFFFAOYSA-N
Compound name
N-[(2-methoxyphenyl)methyl]-1-(oxolan-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.14159 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.14887 151.6
[M+Na]+ 244.13081 162.4
[M+NH4]+ 239.17541 160.2
[M+K]+ 260.10475 157.5
[M-H]- 220.13431 156.9
[M+Na-2H]- 242.11626 157.8
[M]+ 221.14104 154.5
[M]- 221.14214 154.5
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.