CID 138039731

1310708-58-7

Structural Information

Molecular Formula

C₁₁H₁₉NO₃

SMILES

CC(C)(C)OC(=O)N[C@@H]1COC[C@@H]1C=C

InChI

InChI=1S/C11H19NO3/c1-5-8-6-14-7-9(8)12-10(13)15-11(2,3)4/h5,8-9H,1,6-7H2,2-4H3,(H,12,13)/t8-,9+/m0/s1

InChIKey

CNKQXIZXNPGTRO-DTWKUNHWSA-N

Compound name

tert-butyl N-[(3S,4R)-4-ethenyloxolan-3-yl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 213.13649 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	214.143766	150.3
[M+Na]+	236.125708	155.6
[M-H]-	212.129214	154.0
[M+NH4]+	231.170313	169.3
[M+K]+	252.099648	155.8
[M+H-H2O]+	196.133750	145.2
[M+HCOO]-	258.134691	170.6
[M+CH3COO]-	272.150341	187.7
[M+Na-2H]-	234.111156	153.6
[M]+	213.13594142	150.5
[M]-	213.13703858	150.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.