CID 66071753

(3-methoxyoxolan-3-yl)methanamine

Structural Information

Molecular Formula
C6H13NO2
SMILES
COC1(CCOC1)CN
InChI
InChI=1S/C6H13NO2/c1-8-6(4-7)2-3-9-5-6/h2-5,7H2,1H3
InChIKey
PCUCXIDTMZRNBR-UHFFFAOYSA-N
Compound name
(3-methoxyoxolan-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

131.09464 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 125.7
[M+Na]+ 154.08386 132.1
[M-H]- 130.08736 129.2
[M+NH4]+ 149.12846 149.3
[M+K]+ 170.05780 133.2
[M+H-H2O]+ 114.09190 121.2
[M+HCOO]- 176.09284 148.9
[M+CH3COO]- 190.10849 170.7
[M+Na-2H]- 152.06931 132.7
[M]+ 131.09409 124.3
[M]- 131.09519 124.3
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