CID 15601

1729-14-2

Structural Information

Molecular Formula
C15H30N2O4
SMILES
CCCC(C)(COC(=O)NC(C)C)COC(=O)NC(C)C
InChI
InChI=1S/C15H30N2O4/c1-7-8-15(6,9-20-13(18)16-11(2)3)10-21-14(19)17-12(4)5/h11-12H,7-10H2,1-6H3,(H,16,18)(H,17,19)
InChIKey
DXXSFIAPOIOUMX-UHFFFAOYSA-N
Compound name
[2-methyl-2-(propan-2-ylcarbamoyloxymethyl)pentyl] N-propan-2-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

302.22055 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.22783 177.6
[M+Na]+ 325.20977 179.6
[M-H]- 301.21327 176.8
[M+NH4]+ 320.25437 192.1
[M+K]+ 341.18371 180.4
[M+H-H2O]+ 285.21781 171.2
[M+HCOO]- 347.21875 196.4
[M+CH3COO]- 361.23440 211.5
[M+Na-2H]- 323.19522 176.5
[M]+ 302.22000 181.6
[M]- 302.22110 181.6
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