CID 165932795

Tert-butyl n-(3-amino-3-ethylpentyl)carbamate

Structural Information

Molecular Formula
C12H26N2O2
SMILES
CCC(CC)(CCNC(=O)OC(C)(C)C)N
InChI
InChI=1S/C12H26N2O2/c1-6-12(13,7-2)8-9-14-10(15)16-11(3,4)5/h6-9,13H2,1-5H3,(H,14,15)
InChIKey
JBPWYAZYPWCHJO-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-amino-3-ethylpentyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.19943 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.20671 158.2
[M+Na]+ 253.18865 163.8
[M+NH4]+ 248.23325 163.4
[M+K]+ 269.16259 160.8
[M-H]- 229.19215 156.0
[M+Na-2H]- 251.17410 159.0
[M]+ 230.19888 158.0
[M]- 230.19998 158.0
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.