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]+ 212.128126 149.5
[M+Na]+ 234.110068 157.3
[M-H]- 210.113574 151.7
[M+NH4]+ 229.154673 166.4
[M+K]+ 250.084008 156.2
[M+H-H2O]+ 194.118110 138.1
[M+HCOO]- 256.119051 164.2
[M+CH3COO]- 270.134701 194.4
[M+Na-2H]- 232.095516 152.0
[M]+ 211.12030142 144.3
[M]- 211.12139858 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.