CID 83904977

[3-(methoxymethyl)oxolan-3-yl]methanamine

Structural Information

Molecular Formula
C7H15NO2
SMILES
COCC1(CCOC1)CN
InChI
InChI=1S/C7H15NO2/c1-9-5-7(4-8)2-3-10-6-7/h2-6,8H2,1H3
InChIKey
AGOHRXYQMIQOMB-UHFFFAOYSA-N
Compound name
[3-(methoxymethyl)oxolan-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.11028 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 130.3
[M+Na]+ 168.09950 136.3
[M-H]- 144.10300 133.6
[M+NH4]+ 163.14410 153.4
[M+K]+ 184.07344 137.1
[M+H-H2O]+ 128.10754 125.6
[M+HCOO]- 190.10848 153.1
[M+CH3COO]- 204.12413 173.8
[M+Na-2H]- 166.08495 136.8
[M]+ 145.10973 129.2
[M]- 145.11083 129.2
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.