CID 137952042

2307771-20-4

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1([C@@H](C[C@@H]1O)CN)C
InChI
InChI=1S/C7H15NO/c1-7(2)5(4-8)3-6(7)9/h5-6,9H,3-4,8H2,1-2H3/t5-,6-/m0/s1
InChIKey
FAGMXVLCFMWUFE-WDSKDSINSA-N
Compound name
(1S,3R)-3-(aminomethyl)-2,2-dimethylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 129.9
[M+Na]+ 152.10459 136.3
[M-H]- 128.10809 132.3
[M+NH4]+ 147.14919 146.8
[M+K]+ 168.07853 138.0
[M+H-H2O]+ 112.11263 121.4
[M+HCOO]- 174.11357 150.6
[M+CH3COO]- 188.12922 177.0
[M+Na-2H]- 150.09004 134.3
[M]+ 129.11482 136.1
[M]- 129.11592 136.1
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.