CID 137702683

3,5,5-trimethyloxolan-3-amine hydrochloride

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1(CC(CO1)(C)N)C
InChI
InChI=1S/C7H15NO/c1-6(2)4-7(3,8)5-9-6/h4-5,8H2,1-3H3
InChIKey
OVVKEFISDZESPS-UHFFFAOYSA-N
Compound name
3,5,5-trimethyloxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 124.4
[M+Na]+ 152.104588 132.4
[M-H]- 128.108094 128.5
[M+NH4]+ 147.149193 150.6
[M+K]+ 168.078528 132.9
[M+H-H2O]+ 112.112630 121.4
[M+HCOO]- 174.113571 147.0
[M+CH3COO]- 188.129221 172.6
[M+Na-2H]- 150.090036 131.6
[M]+ 129.11482142 122.7
[M]- 129.11591858 122.7
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.