CID 84081602

(1-amino-3-methylcyclobutyl)methanol

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1CC(C1)(CO)N
InChI
InChI=1S/C6H13NO/c1-5-2-6(7,3-5)4-8/h5,8H,2-4,7H2,1H3
InChIKey
CPFSGSLNABFVRU-UHFFFAOYSA-N
Compound name
(1-amino-3-methylcyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

115.09972 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 125.5
[M+Na]+ 138.088938 131.4
[M-H]- 114.092444 127.7
[M+NH4]+ 133.133543 142.6
[M+K]+ 154.062878 133.4
[M+H-H2O]+ 98.096980 116.9
[M+HCOO]- 160.097921 146.6
[M+CH3COO]- 174.113571 172.9
[M+Na-2H]- 136.074386 131.2
[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

No patent data available for this compound.