CID 53671193

[1-(methylamino)cyclobutyl]methanol

Structural Information

Molecular Formula
C6H13NO
SMILES
CNC1(CCC1)CO
InChI
InChI=1S/C6H13NO/c1-7-6(5-8)3-2-4-6/h7-8H,2-5H2,1H3
InChIKey
BAAMMBDGTMPMRK-UHFFFAOYSA-N
Compound name
[1-(methylamino)cyclobutyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

115.09972 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.6
[M+Na]+ 138.08894 129.6
[M-H]- 114.09244 126.9
[M+NH4]+ 133.13354 141.6
[M+K]+ 154.06288 131.9
[M+H-H2O]+ 98.096980 115.7
[M+HCOO]- 160.09792 146.3
[M+CH3COO]- 174.11357 172.5
[M+Na-2H]- 136.07439 132.0
[M]+ 115.09917 130.6
[M]- 115.10027 130.6
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