CID 97043746

Rac-1-[(1r,2s)-2-methylcyclobutyl]methanamine hydrochloride

Structural Information

Molecular Formula
C6H13N
SMILES
C[C@@H]1CC[C@@H]1CN
InChI
InChI=1S/C6H13N/c1-5-2-3-6(5)4-7/h5-6H,2-4,7H2,1H3/t5-,6-/m1/s1
InChIKey
IAYACHHAXQZZTQ-PHDIDXHHSA-N
Compound name
[(1S,2R)-2-methylcyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

99.1048 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.11208 120.1
[M+Na]+ 122.09402 125.7
[M-H]- 98.097524 123.3
[M+NH4]+ 117.13862 136.6
[M+K]+ 138.06796 128.1
[M+H-H2O]+ 82.102060 110.2
[M+HCOO]- 144.10300 142.5
[M+CH3COO]- 158.11865 174.0
[M+Na-2H]- 120.07947 125.4
[M]+ 99.104251 125.7
[M]- 99.105349 125.7
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.