CID 53414987

1095431-22-3

Structural Information

Molecular Formula
C6H13NO
SMILES
COCC(C1CC1)N
InChI
InChI=1S/C6H13NO/c1-8-4-6(7)5-2-3-5/h5-6H,2-4,7H2,1H3
InChIKey
APFVIOCNPBAUSZ-UHFFFAOYSA-N
Compound name
1-cyclopropyl-2-methoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

75
Patents

115.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 123.1
[M+Na]+ 138.088938 131.3
[M-H]- 114.092444 127.4
[M+NH4]+ 133.133543 140.5
[M+K]+ 154.062878 130.1
[M+H-H2O]+ 98.096980 117.4
[M+HCOO]- 160.097921 147.0
[M+CH3COO]- 174.113571 176.1
[M+Na-2H]- 136.074386 129.0
[M]+ 115.09917142 124.7
[M]- 115.10026858 124.7
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

patents stripe