CID 28064564

883311-83-9

Structural Information

Molecular Formula
C6H13NO
SMILES
COCC1(CC1)CN
InChI
InChI=1S/C6H13NO/c1-8-5-6(4-7)2-3-6/h2-5,7H2,1H3
InChIKey
GLLBCNNWOPIIOD-UHFFFAOYSA-N
Compound name
[1-(methoxymethyl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

115.09972 Da
Monoisotopic Mass

-0.3
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

No literature data available for this compound.

Patent stripe

patents stripe