CID 9816868

107202-62-0

Structural Information

Molecular Formula
C15H27NO3
SMILES
CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)[C@H]2CO2
InChI
InChI=1S/C15H27NO3/c1-15(2,3)19-14(17)16-12(13-10-18-13)9-11-7-5-4-6-8-11/h11-13H,4-10H2,1-3H3,(H,16,17)/t12-,13+/m0/s1
InChIKey
JRMDRWOEBLIOTE-QWHCGFSZSA-N
Compound name
tert-butyl N-[(1S)-2-cyclohexyl-1-[(2S)-oxiran-2-yl]ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

269.1991 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.20638 165.8
[M+Na]+ 292.18832 174.5
[M+NH4]+ 287.23292 173.0
[M+K]+ 308.16226 172.1
[M-H]- 268.19182 175.4
[M+Na-2H]- 290.17377 171.2
[M]+ 269.19855 170.6
[M]- 269.19965 170.6
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

patents stripe