CID 118271776

2,5-dimethyloxolan-3-amine hydrochloride

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1CC(C(O1)C)N
InChI
InChI=1S/C6H13NO/c1-4-3-6(7)5(2)8-4/h4-6H,3,7H2,1-2H3
InChIKey
QWPJBFFXUSOVHB-UHFFFAOYSA-N
Compound name
2,5-dimethyloxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

115.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 123.5
[M+Na]+ 138.088938 131.0
[M-H]- 114.092444 127.4
[M+NH4]+ 133.133543 146.5
[M+K]+ 154.062878 131.4
[M+H-H2O]+ 98.096980 118.9
[M+HCOO]- 160.097921 146.4
[M+CH3COO]- 174.113571 171.4
[M+Na-2H]- 136.074386 127.9
[M]+ 115.09917142 121.0
[M]- 115.10026858 121.0
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