CID 10606872

3-(aminomethyl)-n,n-dimethyloxolan-3-amine

Structural Information

Molecular Formula
C7H16N2O
SMILES
CN(C)C1(CCOC1)CN
InChI
InChI=1S/C7H16N2O/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
InChIKey
PPASVTTXWXCGDO-UHFFFAOYSA-N
Compound name
3-(aminomethyl)-N,N-dimethyloxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

144.12627 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.133546 131.4
[M+Na]+ 167.115488 136.7
[M-H]- 143.118994 136.1
[M+NH4]+ 162.160093 154.9
[M+K]+ 183.089428 138.4
[M+H-H2O]+ 127.123530 126.2
[M+HCOO]- 189.124471 155.5
[M+CH3COO]- 203.140121 180.1
[M+Na-2H]- 165.100936 137.4
[M]+ 144.12572142 129.3
[M]- 144.12681858 129.3
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