CID 21109691

912454-49-0

Structural Information

Molecular Formula
C7H15NO
SMILES
CC(CN)(C1CCC1)O
InChI
InChI=1S/C7H15NO/c1-7(9,5-8)6-3-2-4-6/h6,9H,2-5,8H2,1H3
InChIKey
XWXWGCBUWGYOKT-UHFFFAOYSA-N
Compound name
1-amino-2-cyclobutylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

129.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 129.7
[M+Na]+ 152.10459 133.8
[M-H]- 128.10809 131.1
[M+NH4]+ 147.14919 143.9
[M+K]+ 168.07853 135.8
[M+H-H2O]+ 112.11263 119.7
[M+HCOO]- 174.11357 148.9
[M+CH3COO]- 188.12922 175.5
[M+Na-2H]- 150.09004 135.0
[M]+ 129.11482 134.3
[M]- 129.11592 134.3
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