CID 117205

25384-89-8

Structural Information

Molecular Formula
C14H24N2O4
SMILES
CCCC(C)(COC(=O)N)COC(=O)NC(C)(C)C#C
InChI
InChI=1S/C14H24N2O4/c1-6-8-14(5,9-19-11(15)17)10-20-12(18)16-13(3,4)7-2/h2H,6,8-10H2,1,3-5H3,(H2,15,17)(H,16,18)
InChIKey
FCNBIVGBRLYZIR-UHFFFAOYSA-N
Compound name
[2-(carbamoyloxymethyl)-2-methylpentyl] N-(2-methylbut-3-yn-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.1736 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.18088 172.0
[M+Na]+ 307.16282 177.2
[M-H]- 283.16632 170.4
[M+NH4]+ 302.20742 185.1
[M+K]+ 323.13676 177.0
[M+H-H2O]+ 267.17086 160.4
[M+HCOO]- 329.17180 185.5
[M+CH3COO]- 343.18745 211.1
[M+Na-2H]- 305.14827 172.8
[M]+ 284.17305 168.9
[M]- 284.17415 168.9
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

No patent data available for this compound.