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]+ 130.12265 124.4
[M+Na]+ 152.10459 132.4
[M-H]- 128.10809 128.5
[M+NH4]+ 147.14919 150.6
[M+K]+ 168.07853 132.9
[M+H-H2O]+ 112.11263 121.4
[M+HCOO]- 174.11357 147.0
[M+CH3COO]- 188.12922 172.6
[M+Na-2H]- 150.09004 131.6
[M]+ 129.11482 122.7
[M]- 129.11592 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.