CID 4250253

2-amino-2-(4-hydroxycyclohexyl)acetic acid

Structural Information

Molecular Formula
C8H15NO3
SMILES
C1CC(CCC1C(C(=O)O)N)O
InChI
InChI=1S/C8H15NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h5-7,10H,1-4,9H2,(H,11,12)
InChIKey
IMYYCZADDHYKLF-UHFFFAOYSA-N
Compound name
2-amino-2-(4-hydroxycyclohexyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

173.1052 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 137.9
[M+Na]+ 196.09442 144.9
[M+NH4]+ 191.13902 144.4
[M+K]+ 212.06836 142.2
[M-H]- 172.09792 137.6
[M+Na-2H]- 194.07987 139.7
[M]+ 173.10465 138.2
[M]- 173.10575 138.2
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