CID 21975567

2-(n-methyl-2-aminoethyl)-1,3-dioxolane

Structural Information

Molecular Formula
C6H13NO2
SMILES
CNCCC1OCCO1
InChI
InChI=1S/C6H13NO2/c1-7-3-2-6-8-4-5-9-6/h6-7H,2-5H2,1H3
InChIKey
ZUUQKDDUUOFCNP-UHFFFAOYSA-N
Compound name
2-(1,3-dioxolan-2-yl)-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

177
Patents

131.09464 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 127.3
[M+Na]+ 154.08386 132.9
[M-H]- 130.08736 131.5
[M+NH4]+ 149.12846 147.9
[M+K]+ 170.05780 135.0
[M+H-H2O]+ 114.09190 122.1
[M+HCOO]- 176.09284 150.1
[M+CH3COO]- 190.10849 172.0
[M+Na-2H]- 152.06931 135.0
[M]+ 131.09409 127.2
[M]- 131.09519 127.2
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

patents stripe