CID 15248603

170876-73-0

Structural Information

Molecular Formula
C11H21NO3
SMILES
CC(C)[C@@H]([C@H]1CO1)NC(=O)OC(C)(C)C
InChI
InChI=1S/C11H21NO3/c1-7(2)9(8-6-14-8)12-10(13)15-11(3,4)5/h7-9H,6H2,1-5H3,(H,12,13)/t8-,9+/m1/s1
InChIKey
XEANBMDEHAYTRY-BDAKNGLRSA-N
Compound name
tert-butyl N-[(1S)-2-methyl-1-[(2S)-oxiran-2-yl]propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.15215 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.15943 149.8
[M+Na]+ 238.14137 156.4
[M-H]- 214.14487 155.0
[M+NH4]+ 233.18597 162.5
[M+K]+ 254.11531 156.7
[M+H-H2O]+ 198.14941 143.9
[M+HCOO]- 260.15035 169.0
[M+CH3COO]- 274.16600 194.3
[M+Na-2H]- 236.12682 153.6
[M]+ 215.15160 155.2
[M]- 215.15270 155.2
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.