CID 10655060

113486-06-9

Structural Information

Molecular Formula
C10H17NO2
SMILES
CC(C)(C)OC(=O)NC(C)(C)C#C
InChI
InChI=1S/C10H17NO2/c1-7-10(5,6)11-8(12)13-9(2,3)4/h1H,2-6H3,(H,11,12)
InChIKey
RXPXPDDPWDNBGV-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-methylbut-3-yn-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

193
Patents

183.12593 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.133206 146.8
[M+Na]+ 206.115148 154.8
[M-H]- 182.118654 146.7
[M+NH4]+ 201.159753 164.6
[M+K]+ 222.089088 154.4
[M+H-H2O]+ 166.123190 136.6
[M+HCOO]- 228.124131 161.6
[M+CH3COO]- 242.139781 192.7
[M+Na-2H]- 204.100596 151.1
[M]+ 183.12538142 142.9
[M]- 183.12647858 142.9
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