CID 59650929

Tert-butyl n-(2-methylbut-3-yn-1-yl)carbamate

Structural Information

Molecular Formula
C10H17NO2
SMILES
CC(CNC(=O)OC(C)(C)C)C#C
InChI
InChI=1S/C10H17NO2/c1-6-8(2)7-11-9(12)13-10(3,4)5/h1,8H,7H2,2-5H3,(H,11,12)
InChIKey
RVIKGTGYONGIHJ-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-methylbut-3-ynyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

183.12593 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.133206 145.3
[M+Na]+ 206.115148 152.8
[M-H]- 182.118654 144.9
[M+NH4]+ 201.159753 163.0
[M+K]+ 222.089088 152.3
[M+H-H2O]+ 166.123190 134.6
[M+HCOO]- 228.124131 160.7
[M+CH3COO]- 242.139781 193.1
[M+Na-2H]- 204.100596 147.9
[M]+ 183.12538142 141.3
[M]- 183.12647858 141.3
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

patents stripe