CID 17834171

2-methyloxolan-3-amine

Structural Information

Molecular Formula
C5H11NO
SMILES
CC1C(CCO1)N
InChI
InChI=1S/C5H11NO/c1-4-5(6)2-3-7-4/h4-5H,2-3,6H2,1H3
InChIKey
OBFFLNVYKSXULV-UHFFFAOYSA-N
Compound name
2-methyloxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

111
Patents

101.08406 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.091336 119.1
[M+Na]+ 124.073278 126.1
[M-H]- 100.076784 122.8
[M+NH4]+ 119.117883 142.3
[M+K]+ 140.047218 126.8
[M+H-H2O]+ 84.081320 114.4
[M+HCOO]- 146.082261 142.4
[M+CH3COO]- 160.097911 167.2
[M+Na-2H]- 122.058726 124.8
[M]+ 101.08351142 115.9
[M]- 101.08460858 115.9
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