CID 80130645

[(6-methoxypyridin-2-yl)methyl][(3-methyloxetan-3-yl)methyl]amine

Structural Information

Molecular Formula
C12H18N2O2
SMILES
CC1(COC1)CNCC2=NC(=CC=C2)OC
InChI
InChI=1S/C12H18N2O2/c1-12(8-16-9-12)7-13-6-10-4-3-5-11(14-10)15-2/h3-5,13H,6-9H2,1-2H3
InChIKey
NBINZIQBRJSRCS-UHFFFAOYSA-N
Compound name
1-(6-methoxy-2-pyridinyl)-N-[(3-methyloxetan-3-yl)methyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.13683 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.144106 147.9
[M+Na]+ 245.126048 153.2
[M-H]- 221.129554 153.6
[M+NH4]+ 240.170653 158.8
[M+K]+ 261.099988 155.8
[M+H-H2O]+ 205.134090 135.5
[M+HCOO]- 267.135031 168.9
[M+CH3COO]- 281.150681 193.7
[M+Na-2H]- 243.111496 155.7
[M]+ 222.13628142 158.5
[M]- 222.13737858 158.5
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.