CID 10352168

155899-66-4

Structural Information

Molecular Formula
C8H15NO3
SMILES
CC1(O[C@H]2[C@@H](C[C@@H]([C@H]2O1)O)N)C
InChI
InChI=1S/C8H15NO3/c1-8(2)11-6-4(9)3-5(10)7(6)12-8/h4-7,10H,3,9H2,1-2H3/t4-,5+,6+,7-/m1/s1
InChIKey
AXPYGRDXRLICKY-JRTVQGFMSA-N
Compound name
(3aR,4S,6R,6aS)-6-amino-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

138
Patents

173.1052 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.11248 134.7
[M+Na]+ 196.09442 142.4
[M+NH4]+ 191.13902 144.0
[M+K]+ 212.06836 141.4
[M-H]- 172.09792 137.6
[M+Na-2H]- 194.07987 136.1
[M]+ 173.10465 136.4
[M]- 173.10575 136.4
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