CID 83694180

2-amino-1-(1-methylcyclopropyl)ethan-1-ol

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1(CC1)C(CN)O
InChI
InChI=1S/C6H13NO/c1-6(2-3-6)5(8)4-7/h5,8H,2-4,7H2,1H3
InChIKey
HSKOVXSDGPPHJZ-UHFFFAOYSA-N
Compound name
2-amino-1-(1-methylcyclopropyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 122.8
[M+Na]+ 138.088938 131.3
[M-H]- 114.092444 126.1
[M+NH4]+ 133.133543 141.4
[M+K]+ 154.062878 130.1
[M+H-H2O]+ 98.096980 118.8
[M+HCOO]- 160.097921 144.9
[M+CH3COO]- 174.113571 173.2
[M+Na-2H]- 136.074386 129.3
[M]+ 115.09917142 123.1
[M]- 115.10026858 123.1
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.