CID 53407227

1220039-33-7

Structural Information

Molecular Formula
C6H13NO
SMILES
COCC1(CCC1)N
InChI
InChI=1S/C6H13NO/c1-8-5-6(7)3-2-4-6/h2-5,7H2,1H3
InChIKey
OELKIVVMDJOKLG-UHFFFAOYSA-N
Compound name
1-(methoxymethyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
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 123.9
[M+Na]+ 138.088938 129.4
[M-H]- 114.092444 127.2
[M+NH4]+ 133.133543 141.4
[M+K]+ 154.062878 132.2
[M+H-H2O]+ 98.096980 114.9
[M+HCOO]- 160.097921 146.5
[M+CH3COO]- 174.113571 174.4
[M+Na-2H]- 136.074386 130.9
[M]+ 115.09917142 130.9
[M]- 115.10026858 130.9
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