CID 14146220

(1-aminocyclopropyl)methanol

Structural Information

Molecular Formula
C4H9NO
SMILES
C1CC1(CO)N
InChI
InChI=1S/C4H9NO/c5-4(3-6)1-2-4/h6H,1-3,5H2
InChIKey
OBMKZINZPBARIK-UHFFFAOYSA-N
Compound name
(1-aminocyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1322
Patents

87.06841 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.075686 114.6
[M+Na]+ 110.05763 124.1
[M-H]- 86.061134 118.2
[M+NH4]+ 105.10223 134.2
[M+K]+ 126.03157 122.9
[M+H-H2O]+ 70.065670 110.7
[M+HCOO]- 132.06661 138.2
[M+CH3COO]- 146.08226 166.6
[M+Na-2H]- 108.04308 123.2
[M]+ 87.067861 114.7
[M]- 87.068959 114.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe