CID 138987711

2305255-01-8

Structural Information

Molecular Formula
C13H25NO5
SMILES
CC(C)(C)OC(=O)NCC1(CC(C1)(OC)OC)CO
InChI
InChI=1S/C13H25NO5/c1-11(2,3)19-10(16)14-8-12(9-15)6-13(7-12,17-4)18-5/h15H,6-9H2,1-5H3,(H,14,16)
InChIKey
YTPQKVDFEZMIGZ-UHFFFAOYSA-N
Compound name
tert-butyl N-[[1-(hydroxymethyl)-3,3-dimethoxycyclobutyl]methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.17328 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.18056 168.7
[M+Na]+ 298.16250 170.3
[M+NH4]+ 293.20710 171.9
[M+K]+ 314.13644 166.1
[M-H]- 274.16600 163.8
[M+Na-2H]- 296.14795 169.8
[M]+ 275.17273 166.2
[M]- 275.17383 166.2
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

No patent data available for this compound.