CID 45092124

152601-79-1

Structural Information

Molecular Formula
C11H17NO3
SMILES
CC(C)(C)OC(=O)NC1CCOC1C#C
InChI
InChI=1S/C11H17NO3/c1-5-9-8(6-7-14-9)12-10(13)15-11(2,3)4/h1,8-9H,6-7H2,2-4H3,(H,12,13)
InChIKey
ZZYCHWANMWNDOH-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-ethynyloxolan-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 149.5
[M+Na]+ 234.11007 157.3
[M-H]- 210.11357 151.7
[M+NH4]+ 229.15467 166.4
[M+K]+ 250.08401 156.2
[M+H-H2O]+ 194.11811 138.1
[M+HCOO]- 256.11905 164.2
[M+CH3COO]- 270.13470 194.4
[M+Na-2H]- 232.09552 152.0
[M]+ 211.12030 144.3
[M]- 211.12140 144.3
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.