CID 131101215

Methyl 3-amino-5,5-dimethyloxolane-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC1(CC(CO1)(C(=O)OC)N)C
InChI
InChI=1S/C8H15NO3/c1-7(2)4-8(9,5-12-7)6(10)11-3/h4-5,9H2,1-3H3
InChIKey
ZWUDJLCIUJCHEA-UHFFFAOYSA-N
Compound name
methyl 3-amino-5,5-dimethyloxolane-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.1052 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.112476 134.4
[M+Na]+ 196.094418 142.0
[M-H]- 172.097924 138.4
[M+NH4]+ 191.139023 158.6
[M+K]+ 212.068358 143.1
[M+H-H2O]+ 156.102460 131.3
[M+HCOO]- 218.103401 156.3
[M+CH3COO]- 232.119051 179.2
[M+Na-2H]- 194.079866 140.2
[M]+ 173.10465142 134.6
[M]- 173.10574858 134.6
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.