CID 122163632

2832887-25-7

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC1(CN[C@@H]2COC[C@H]2O1)C
InChI
InChI=1S/C8H15NO2/c1-8(2)5-9-6-3-10-4-7(6)11-8/h6-7,9H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKey
NFCIMLODCWRFAM-RNFRBKRXSA-N
Compound name
(4aR,7aS)-2,2-dimethyl-3,4,4a,5,7,7a-hexahydrofuro[3,4-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 132.9
[M+Na]+ 180.09950 139.6
[M-H]- 156.10300 135.3
[M+NH4]+ 175.14410 153.9
[M+K]+ 196.07344 140.1
[M+H-H2O]+ 140.10754 128.0
[M+HCOO]- 202.10848 148.3
[M+CH3COO]- 216.12413 145.6
[M+Na-2H]- 178.08495 139.8
[M]+ 157.10973 129.6
[M]- 157.11083 129.6
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.