CID 57790745

1231730-23-6

Structural Information

Molecular Formula
C6H13NO
SMILES
CCOCC1(CC1)N
InChI
InChI=1S/C6H13NO/c1-2-8-5-6(7)3-4-6/h2-5,7H2,1H3
InChIKey
HVHWGPDMFDCKCC-UHFFFAOYSA-N
Compound name
1-(ethoxymethyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
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 123.7
[M+Na]+ 138.088938 132.8
[M-H]- 114.092444 128.3
[M+NH4]+ 133.133543 143.0
[M+K]+ 154.062878 132.1
[M+H-H2O]+ 98.096980 119.2
[M+HCOO]- 160.097921 148.2
[M+CH3COO]- 174.113571 174.9
[M+Na-2H]- 136.074386 131.7
[M]+ 115.09917142 126.3
[M]- 115.10026858 126.3
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