CID 102594465

Cis-4-tert-butoxycarbonylamino-tetrahydro-furan-3-carboxylic acid

Structural Information

Molecular Formula
C10H17NO5
SMILES
CC(C)(C)OC(=O)N[C@H]1COC[C@H]1C(=O)O
InChI
InChI=1S/C10H17NO5/c1-10(2,3)16-9(14)11-7-5-15-4-6(7)8(12)13/h6-7H,4-5H2,1-3H3,(H,11,14)(H,12,13)/t6-,7+/m1/s1
InChIKey
FUECAVZSGQIGRI-RQJHMYQMSA-N
Compound name
(3S,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]oxolane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

231.11067 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.11795 151.2
[M+Na]+ 254.09989 156.7
[M+NH4]+ 249.14449 155.9
[M+K]+ 270.07383 157.7
[M-H]- 230.10339 150.1
[M+Na-2H]- 252.08534 151.1
[M]+ 231.11012 151.0
[M]- 231.11122 151.0
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