CID 86617883

1824163-90-7

Structural Information

Molecular Formula
C13H25NO5
SMILES
CC(C)(C)OC(=O)N(CCCO)C(=O)OC(C)(C)C
InChI
InChI=1S/C13H25NO5/c1-12(2,3)18-10(16)14(8-7-9-15)11(17)19-13(4,5)6/h15H,7-9H2,1-6H3
InChIKey
OHUHJOQGBBBLLU-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-hydroxypropyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

275.17328 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.18056 164.8
[M+Na]+ 298.16250 169.9
[M+NH4]+ 293.20710 168.3
[M+K]+ 314.13644 169.3
[M-H]- 274.16600 160.3
[M+Na-2H]- 296.14795 164.2
[M]+ 275.17273 163.8
[M]- 275.17383 163.8
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